Hugging Face's logo

Datasets:
Kinsleykinsley
/
Monooxygenase_sequences

Modalities:
Text
Formats:
csv
Size:
1K - 10K
Libraries:
Datasets
pandas
License:
Dataset card Data Studio Files
xet
Community
1
Dataset Viewer
Auto-converted to Parquet Duplicate
monooxygenase_final_dataset
stringclasses
480 values
__index_level_0__
float64
0
9.04k
⌀
__index_level_1__
stringclasses
2 values
__index_level_2__
stringclasses
60 values
__index_level_3__
stringlengths
8
1.57k
__index_level_4__
stringclasses
51 values
__index_level_5__
stringclasses
57 values
__index_level_6__
stringlengths
6
11
__index_level_7__
stringclasses
480 values
product_descriptors
null
enzyme_class
pollutant
sequence
reactant_descriptors
reactant_smiles
uniprot_ids
product_smiles
[[364.78999999999996, 744.4170000000003, -2.898899999999998, 9, 18, 13, 3, 0.47619047619047616, 150.28740000000005, 1], [40.46, 110.11199999999997, 1.0977999999999999, 2, 2, 0, 1, 0.0, 29.771599999999992, 0]]
0
monooxygenase
Benzene
MPTKIQIVFYSSYGHIYKMAEAIAAGAREVGDVEVTLLQVPELMPEEVQVKSGIKGYRAAFGSIPYATPEVLAEADAIIFGTPTRFGNMCSQMRNFLDQTGGLWMSGGLIGKVGSVFTSTASQHGGQETTITSFHTTLLHHGMVIVGVPYSEPGLTNMTEISGGTPYGASTLAGADGSRQPSENELQIARFQGKHVATIAKRLANNK
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
C1I202
['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)OP(=O)(O)O)O)O)O)C(=O)N', 'C1=CC(=CC=C1O)O']
[[35.0, 17.031, 0.16199999999999998, 1, 1, 0, 0, 0.0, 5.0221, 0], [40.46, 110.11199999999997, 1.0977999999999994, 2, 2, 0, 1, 0.0, 29.771599999999992, 0], [34.14, 44.009, -0.5835, 0, 2, 0, 0, 0.0, 5.007, 0], [364.78999999999996, 744.4170000000003, -2.898899999999998, 9, 18, 13, 3, 0.47619047619047616, 150.28740000000005, 1], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1]]
1
monooxygenase
Benzene
MTARNLAEWQNFVQGCIDFRPNDGVYRIARDMFTEPELFELEMELIFEKVWIYACHESEIPNNNDFVTVQIGRQPMIVSRDGKGELHAMVNACEHRGATLTRVAKGNQSVFTCPFHAWCYKSDGRLVKVKAPGEYCEDFDKSSRGLKQGRIASYRGFVFVSLDTQATDSLEDFLGDAKVFLDLMVDQSPTGELEVLQGKSAYTFAGNWKLQNENGLDGYHVSTVHYNYVSTVQHRQQVNAAKGDELDTLDYSKLGAGDSETDDGWFSFKNGHSVLFSDMPNPTVRPGYNTVMPYLVEKFGEKRAEWAMHRLRNLNLYPSLFFMDQISSQLRIIRPVAWNKTEVISQCIGVKGESSEARRNRIRQFEDFFNVSGLGTPDDLVEFREQQKGFQGRIERWSDISRGYHQWTYGPTQNSQDLGIEPVITGREFTHEGLYVNQHGQWQRLILDGLNKKALKMHDVTFDNQSVMDEV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
O85673
['N', 'C1=CC=C(C(=C1)O)O', 'C(=O)=O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)OP(=O)(O)O)O)O)O)C(=O)N', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N']
[[318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [40.46, 112.12799999999997, -0.16580000000000006, 2, 2, 0, 0, 0.3333333333333333, 30.293599999999984, 0]]
2
monooxygenase
Benzene
MNQTDTSPIRLRRSWNTSEIEALFDEHAGRIDPRIYTDEDLYQLELERVFARSWLLLGHETQIRKPGDYITTYMGEDPVVVVRQKDASIAVFLNQCRHRGMRICRADAGNAKAFTCSYHGWAYDTAGNLVNVPYEAESFACLNKKEWSPLKARVETYKGLIFANWDENAVDLDTYLGEAKFYMDHMLDRTEAGTEAIPGVQKWVIPCNWKFAAEQFCSDMYHAGTTSHLSGILAGLPEDLEMADLAPPTVGKQYRASWGGHGSGFYVGDPNLMLAIMGPKVTSYWTEGPASEKAAERLGSVERGSKLMVEHMTVFPTCSFLPGINTVRTWHPRGPNEVEVWAFTVVDADAPDDIKEEFRRQTLRTFSAGGVFEQDDGENWVEIQHILRGHKARSRPFNAEMSMDQTVDNDPVYPGRISNNVYSEEAARGLYAHWLRMMTSPDWDALKATR
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A5W4F2
['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'C1=C[C@H]([C@H](C=C1)O)O']
[[20.23, 94.11299999999997, 1.3921999999999997, 1, 1, 0, 1, 0.0, 28.106799999999993, 0], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0], [40.46, 110.11199999999997, 1.0977999999999994, 2, 2, 0, 1, 0.0, 29.771599999999992, 0]]
3
monooxygenase
Benzene
MSYNVTIEPTGEVIEVEDGQTILQAALRQGVWLPFACGHGTCATCKVQVVEGEVDIGEASPFALMDIERDERKVLACCAIPLSDLVIEADVDADPDFLGHPVEDYRGVVSALVDLSPTIKGLHIKLDRPMPFQAGQYVNLALPGIDGTRAFSLANPPSRNDEVELHVRLVEGGAATGFIHKQLKVGDAVELSGPYGQFFVRDSQAGDLIFIAGGSGLSSPQSMILDLLERGDTRRITLFQGARNRAELYNCELFEELAARHPNFSYVPALNQANDDPEWQGFKGFVHDAAKAHFDGRFGGQKAYLCGPPPMIDAAITTLMQGRLFERDIFMERFYTAADGAGESSRSALFKRI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
P19734
['C1=CC=C(C=C1)O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'O', 'C1=CC=C(C(=C1)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [222.14, 472.3470000000001, -2.3681599999999987, 6, 10, 7, 1, 0.4117647058823529, 107.69620000000002, 0], [57.53, 234.27599999999998, 2.6398000000000006, 2, 2, 2, 2, 0.0, 62.58000000000003, 0], [229.10999999999996, 490.36200000000014, -1.1337600000000003, 8, 11, 8, 2, 0.4117647058823529, 112.47470000000006, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]]
4
monooxygenase
Benzene
MTQQRQMHLAGFFSAGNVTHAHGAWRHTDASNDFLSGKYYQHIARTLERGKFDLLFLPDGLAVEDSYGDNLDTGVGLGGQGAVALEPASVVATMAAVTEHLGLGATISATYYPPYHVARVFATLDQLSGGRVSWNVVTSLNDAEARNFGINQHLEHDARYDRADEFLEAVKKLWNSWDEDALVLDKAAGVFADPAKVHYVDHHGEWLNVRGPLQVPRSPQGEPVILQAGLSPRGRRFAGKWAEAVFSLAPNLEVMQATYQGIKAEVDAAGRDPDQTKIFTAVMPVLGESQAVAQERLEYLNSLVHPEVGLSTLSSHTGINLAAYPLDTPIKDILRDLQDRNVPTQLHMFAAATHSEELTLAEMGRRYGTNVGFVPQWAGTGEQIADELIRHFEGGAADGFIISPAFLPGSYDEFVDQVVPVLQDRGYFRTEYQGNTLRDHLGLRVPQLQGQPS
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
P54995
['[H+]', 'CC1=CC2=C(C=C1C)[N+](=C3C(=O)NC(=O)N=C3N2C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O)[O-]', 'C1=CC=C(C(=C1)C2=CC=CC=C2S(=O)O)O', 'CC1=CC2=C(C=C1C)N(C3=C(N2C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O)NC(=O)NC3=O)OO', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'O']
[[20.23, 170.21099999999996, 3.059200000000001, 1, 1, 1, 2, 0.0, 53.54280000000003, 0], [57.53, 82.07999999999998, -0.3189, 2, 1, 0, 0, 0.0, 13.4, 0]]
5
monooxygenase
Benzene
MTSRVDPANPGSELDSAIRDTLTYSNCPVPNALLTASESGFLDAAGIELDVLSGQQGTVHFTYDQPAYTRFGGEIPPLLSEGLRAPGRTRLLGITPLLGRQGFFVRDDSPITAAADLAGRRIGVSASAIRILRGQLGDYLELDPWRQTLVALGSWEARALLHTLEHGELGVDDVELVPISSPGVDVPAEQLEESATVKGADLFPDVARGQAAVLASGDVDALYSWLPWAGELQATGARPVVDLGLDERNAYASVWTVSSGLVRQRPGLVQRLVDAAVDAGLWARDHSDAVTSLHAANLGVSTGAVGQGFGADFQQRLVPRLDHDALALLERTQQFLLTNNLLQEPVALDQWAAPEFLNNSLNRHR
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
P0DW79
['C1=CC=C(C=C1)C2=CC=CC=C2O', 'OS(=O)O']
[[318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [20.23, 108.13999999999999, 1.7006199999999996, 1, 1, 0, 1, 0.14285714285714285, 32.843799999999995, 0], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]]
6
monooxygenase
Benzene
MAMHPRKDWYELTRATNWTPSYVTEEQLFPERMSGHMGIPLEKWESYDEPYKTSYPEYVSIQREKDAGAYSVKAALERAKIYENSDPGWISTLKSHYGAIAVGEYAAVTGEGRMARFSKAPGNRNMATFGMMDELRHGQLQLFFPHEYCKKDRQFDWAWRAYHSNEWAAIAAKHFFDDIITGRDAISVAIMLTFSFETGFTNMQFLGLAADAAEAGDYTFANLISSIQTDESRHAQQGGPALQLLIENGKREEAQKKVDMAIWRAWRLFAVLTGPVMDYYTPLEDRSQSFKEFMYEWIIGQFERSLIDLGLDKPWYWDLFLKDIDELHHSYHMGVWYWRTTAWWNPAAGVTPEERDWLEEKYPGWNKRWGRCWDVITENVLNDRMDLVSPETLPSVCNMSQIPLVGVPGDDWNIEVFSLEHNGRLYHFGSEVDRWVFQQDPVQYQNHMNIVDRFLAGQIQPMTLEGALKYMGFQSIEEMGKDAHDFAWADKCKPAMKKSA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q00456
['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'CC1=CC=C(C=C1)O', 'O']
[[318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [115.06, 200.146, -1.2561999999999998, 4, 4, 2, 0, 0.25, 43.4512, 0]]
7
monooxygenase
Benzene
MQESIIQWHGATNTRVPFGIYTDTANADQEQQRIYRGEVWNYLCLESEIPGAGDFRTTFAGETPIVVVRDADQEIYAFENRCAHRGALIALEKSGRTDSFQCVYHAWSYNRQGDLTGVAFEKGVKGQGGMPASFCKEEHGPRKLRVAVFCGLVFGSFSEDVPSIEDYLGPEICERIERVLHKPVEVIGRFTQKLPNNWKLYFENVKDSYHASLLHMFFTTFELNRLSQKGGVIVDESGGHHVSYSMIDRGAKDDSYKDQAIRSDNERYRLKDPSLLEGFEEFEDGVTLQILSVFPGFVLQQIQNSIAVRQLLPKSISSSELNWTYLGYADDSAEQRKVRLKQANLIGPAGFISMEDGAVGGFVQRGIAGAANLDAVIEMGGDHEGSSEGRATETSVRGFWKAYRKHMGQEMQA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q3C1D5
['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'C1=C[C@@]([C@H](C=C1C(=O)O)O)(C(=O)O)O']
[[318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [115.06, 200.146, -1.2561999999999998, 4, 4, 2, 0, 0.25, 43.4512, 0]]
8
monooxygenase
Benzene
MQESIIQWHGATNTRVPFGIYTDTANADQEQQRIYRGEVWNYLCLESEIPGAGDFRTTFAGETPIVVVRDADQEIYAFENRCAHRGALIALEKSGRTDSFQCVYHAWSYNRQGDLTGVAFEKGVKGQGGMPASFCKEEHGPRKLRVAVFCGLVFGSFSEDVPSIEDYLGPEICERIERVLHKPVEVIGRFTQKLPNNWKLYFENVKDSYHASLLHMFFTTFELNRLSQKGGVIVDESGGHHVSYSMIDRSAKDDSYKDQAIRSDNERYRLKDPSLLEGFEEFEDGVTLQILSVFPGFVLQQIQNSIAVRQLLPKSISSSELNWTYLGYADDSTEQRKVRLKQANLIGPAGFISMEDGAVGGFVQRGIAGAANLDAVIEMGGDHEGSSEGRATETSVRGFWKAYRKHMGQEMQA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q3C1E3
['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'C1=C[C@@]([C@H](C=C1C(=O)O)O)(C(=O)O)O']
[[364.78999999999996, 744.4170000000003, -2.898899999999998, 9, 18, 13, 3, 0.47619047619047616, 150.28740000000005, 1], [40.46, 222.671, 2.0150000000000006, 2, 2, 1, 1, 0.16666666666666666, 60.58260000000003, 0], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [40.46, 188.22599999999997, 1.3616, 2, 2, 1, 1, 0.16666666666666666, 55.57260000000003, 0]]
9
monooxygenase
Benzene
MTDVQCEPALAGRKPKWADADIAELVDERTGRLDPRIYTDEALYEQELERIFGRSWLLMGHETQIPKAGDFMTNYMGEDPVMVVRQKNGEIRVFLNQCRHRGMRICRADGGNAKSFTCSYHGWAYDTGGNLVSVPFEEQAFPGLRKEDWGPLQARVETYKGLIFANWDADAPDLDTYLGEAKFYMDHMLDRTEAGTEAIPGIQKWVIPCNWKFAAEQFCSDMYHAGTTSHLSGILAGLPDGVDLSELAPPTEGIQYRATWGGHGSGFYIGDPNLLLAIMGPKVTEYWTQGPAAEKASERLGSTERGQQLMAQHMTIFPTCSFLPGINTIRAWHPRGPNEIEVWAFTVVDADAPEEMKEEYRQQTLRTFSAGGVFEQDDGENWVEIQQVLRGHKARSRPFNAEMGLGQTDSDNPDYPGTISYVYSEEAARGLYTQWVRMMTSPDWAALDATRPAVSESTHT
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q53122
['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)OP(=O)(O)O)O)O)O)C(=O)N', 'C1=C[C@@H]([C@@H](C(=C1)C2=CC=C(C=C2)Cl)O)O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'C1=CC=C(C=C1)C2=CC=C[C@@H]([C@@H]2O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
10
monooxygenase
Benzene
MSQLEPRQQAFRNAMAHLSAAVNVITSNGPAGRCGITATAVCSVTDSPPTLMLCINRNSEMNTVFKANGRLCVNVLSGEHEEVARHFAGMTEVPMERRFALHDWREGLAGLPVLHGALANLQGRIAEVQEIGTHSVLLLELEDIQVLEQGDGLVYFSRSFHRLQCPRRAA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q9HWT6
['[H+]', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[20.23, 60.096000000000004, 0.38710000000000006, 1, 1, 0, 0, 1.0, 17.354800000000004, 0], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]]
11
monooxygenase
Benzene
MSRQSLTKAHAKISELTWEPTFATPATRFGTDYTFEKAPKKDPLKQIMRSYFSMEEEKDNRVYGAMDGAIRGNMFRQVQQRWLEWQKLFLSIIPFPEISAARAMPMAIDAVPNPEIHNGLAVQMIDEVRHSTIQMNLKKLYMNNYIDPSGFDMTEKAFANNYAGTIGRQFGEGFITGDAITAANIYLTVVAETAFTNTLFVAMPDEAAANGDYLLPTVFHSVQSDESRHISNGYSILLMALADERNRPLLERDLRYAWWNNHCVVDAAIGTFIEYGTKDRRKDRESYAEMWRRWIYDDYYRSYLLPLEKYGLTIPHDLVEEAWKRIVEKGYVHEVARFFATGWPVNYWRIDTMTDTDFEWFEHKYPGWYSKFGKWWENYNRLAYPGRNKPIAFEEVGYQYPHRCWTCMVPALIREDMIVEKVDGQWRTYCSETCYWTDAVAFRGEYEGRETPNMGRLTGFREWETLHHGKDLADIVTDLGYVRDDGKTLVGQPHLNLDPQKMWTLDDVRGNTFNSPNVLLNQMTDDERDAHVAAYRAGGVPA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0QTU8
['CC(C)O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'O']
[[318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [40.46, 112.12799999999997, -0.16580000000000006, 2, 2, 0, 0, 0.3333333333333333, 30.293599999999984, 0]]
12
monooxygenase
Benzene
MNQTDTSPIRLRRSWNTSEIEALFDEHAGRIDPRIYTDEDLYQLELERVFARSWLLLGHETQIRKPGDYITTYMGEDPVVVVRQKDASIAVFLNQCRHRGMRICRADAGNAKAFTCSYHGWAYDTAGNLVNVPYEAESFACLNKKEWSPLKARVETYKGLIFANWDENAVDLDTYLGEAKFYMDHMLDRTEAGTEAIPGVQKWVIPCNWKFAAEQFCSDMYHAGTTSHLSGILAGLPEDLEMADLAPPTVGKQYRASWGGHGSGFYVGDPNLMLAIMGPKVTSYWTEGPASEKAAERLGSVERGSKLMVEHMTVFPTCSFLPGINTVRTWHPRGPNEVEVWAFTVVDADAPDDIKEEFRRQTLRTFSAGGVFEQDDGENWVEIQHILRGHKARSRPFNAEMSMDQTVDNDPVYPGRISNNVYSEEAARGLYAHWLRMMTSPDWDALKATR
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A5W4F2
['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'C1=C[C@H]([C@H](C=C1)O)O']
[[20.23, 60.096000000000004, 0.38710000000000006, 1, 1, 0, 0, 1.0, 17.354800000000004, 0], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]]
13
monooxygenase
Benzene
MSRQSLTKAHAKISELTWEPTFATPATRFGTDYTFEKAPKKDPLKQIMRSYFSMEEEKDNRVYGAMDGAIRGNMFRQVQQRWLEWQKLFLSIIPFPEISAARAMPMAIDAVPNPEIHNGLAVQMIDEVRHSTIQMNLKKLYMNNYIDPAGFDMTEKAFANNYAGTIGRQFGEGFITGDAITAANIYLTVVAETAFTNTLFVAMPDEAAANGDYLLPTVFHSVQSDESRHISNGYSILLMALADERNRPLLERDLRYAWWNNHCVVDAAIGTFIEYGTKDRRKDRESYAEMWRRWIYDDYYRSYLLPLEKYGLTIPHDLVEEAWKRIVEKGYVHEVARFFATGWPVNYWRIDTMTDTDFEWFEHKYPGWYNKFGKWWENYNRLAYPGRNKPIAFEEVGYQYPHRCWTCMVPALIREDMIVEKVDGQWRTYCSETCYWTDAVAFRGEYEGRATPNMGRLTGFREWETLHHGKDLADIVTDLGYVRDDGKTLVGQPHLDLDPQKMWTLDDVRGNTFNSPNVLLNQMTNDERDAHVAAYRAGGVPA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
E9RFS9
['CC(C)O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'O']
[[20.23, 60.096000000000004, 0.38710000000000006, 1, 1, 0, 0, 1.0, 17.354800000000004, 0], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]]
14
monooxygenase
Benzene
MSAPEKPRERSFPKIEFTDSEAGAKEFPSSKSRSYSYFTPAKLRATMYEDVTVDVQPDPDRHLTQGWIYGFGNGPGGYPKDWTTAKSSDWHAFRDPNEEWNQTIYRNNAAVVRQVELCLKNAKRARVYDGWNSTWLTFIERNVGAWMHAENGLALHVFTSIQRSGPTNMINTAVAVNAAHKMRFAQDLALFNLDLAEATEAFDGSAHRAVWQEAREWQATRKVVEELTAVGDWCQLLFATNIVFEQLVGSLFRTELIMQIAARNGDYITPTIVGTGEHDYDRDLNYTRNLFRLLTRDPEHGEANKALFTEWLGIWVPRCLDAALALQPIWSAPADKAVTFASSLDAAKAKFTALLEEIDLDIPEELNK
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
I7FA35
['CC(C)O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'O']
[[12.53, 44.053, 0.016600000000000004, 0, 1, 0, 0, 1.0, 10.819, 0], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [12.53, 78.49799999999999, 0.5815, 0, 1, 0, 0, 1.0, 15.593000000000002, 0], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]]
15
monooxygenase
Benzene
MALLNRDDWYDIARDVDWTLSYVDRAVAFPEEWKGEKDICGTAWDDWDEPFRVSFREYVMVQRDKEASVGAIREAMVRAKAYEKLDDGHKATSHLHMGTITMVEHMAVTMQSRFVRFAPSARWRSLGAFGMLDETRHTQLDLRFSHDLLNDSPSFDWSQRAFHTDEWAVLATRNLFDDIMLNADCVEAALATSLTLEHGFTNIQFVALASDAMEAGDVNFSNLLSSIQTDEARHAQLGFPTLDVMMKHDPKRAQQILDVAFWRSYRIFQAVTGVSMDYYTPVAKRQMSFKEFMLEWIVKHHERILRDYGLQKPWYWDTFEKTLDHGHHALHIGTWFWRPTLFWDPNGGVSREERRWLNQKYPNWEESWGVLWDEIISNINAGNIEKTLPETLPMLCNVTNLPIGSHWDRFHLKPEQLVYKGRLYTFDSDVSKWIFELDPERYAGHTNVVDRFIGGQIQPMTIEGVLNWMGLTPEVMGKDVFNYRWAGDYAENRIAAE
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
O87082
['C1CO1', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'C1C(O1)Cl', 'O']
[[20.23, 94.11299999999997, 1.3921999999999997, 1, 1, 0, 1, 0.0, 28.106799999999993, 0], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0], [40.46, 110.11199999999997, 1.0977999999999994, 2, 2, 0, 1, 0.0, 29.771599999999992, 0]]
16
monooxygenase
Benzene
MSVEIKTNTVDPIRQTYGNLQRRFGDKPASRYQEASYDIEAVTNFHYRPLWDPQHELHDPTRTAIRMTDWHKVTDPRQFYYGAYVQTRARMQEATEHAYGFCEKRELLSRLPAELQAKLLRCLVPLRHAELGANMNNSSIAGDSIAATVTQMHIYQAMDRLGMGQYLSRIGLLLDGGTGEALDQAKAYWLDDPIWQGLRRYVEDSFVIRDWFELGLAQNLVLDGLLQPLMYQRFDQWLTENGGSDVAMLTEFMRDWYGESTRWVDAMFKTVLAENDANREQVQAWLEVWEPRAYEALLPLAEEATGIAALDEVRSAFATRLQKIGLKSREE
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
P19730
['C1=CC=C(C=C1)O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'O', 'C1=CC=C(C(=C1)O)O']
[[20.23, 94.11299999999997, 1.3921999999999997, 1, 1, 0, 1, 0.0, 28.106799999999993, 0], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0], [40.46, 110.11199999999997, 1.0977999999999994, 2, 2, 0, 1, 0.0, 29.771599999999992, 0]]
17
monooxygenase
Benzene
MSSLVYIAFQDNDNARYVVEAIIQDNPHAVVQHHPAMIRIEAEKRLEIRRETVEENLGRAWDVQEMLVDVITIGGNVDEDDDRFVLEWKN
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
P19731
['C1=CC=C(C=C1)O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'O', 'C1=CC=C(C(=C1)O)O']
[[20.23, 94.11299999999997, 1.3921999999999997, 1, 1, 0, 1, 0.0, 28.106799999999993, 0], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0], [40.46, 110.11199999999997, 1.0977999999999994, 2, 2, 0, 1, 0.0, 29.771599999999992, 0]]
18
monooxygenase
Benzene
MATHNKKRLNLKDKYRYLTRDLAWETTYQKKEDVFPLEHFEGIKITDWDKWEDPFRLTMDTYWKYQAEKEKKLYAIFDAFAQNNGHQNISDARYVNALKLFLTAVSPLEYQAFQGFSRVGRQFSGAGARVACQMQAIDELRHVQTQVHAMSHYNKHFDGLHDFAHMYDRVWYLSVPKSYMDDARTAGPFEFLTAVSFSFEYVLTNLLFVPFMSGAAYNGDMATVTFGFSAQSDEARHMTLGLEVIKFMLEQHEDNVPIIQRWIDKWFWRGYRLLTLIGMMMDYMLPNKVMSWSEAWGVYFEQAGGALFKDLERYGIRPPKYVEQTTIGKEHITHQVWGALYQYSKATSFHTWIPGDEELNWLSEKYPDTFDKYYRPRFEFWREQQAKGERFYNDTLPHLCQVCQLPVIFTEPDDPTKLSLRSLVHEGERYQFCSDGCCDIFKNEPVKYIQAWLPVHQIYQGNCEGGDVETVVQKYYHIKSGVDNLEYLGSPEHQRWLALKGQTPPTAAPADKSLGAA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
P19732
['C1=CC=C(C=C1)O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'O', 'C1=CC=C(C(=C1)O)O']
[[20.23, 94.11299999999997, 1.3921999999999997, 1, 1, 0, 1, 0.0, 28.106799999999993, 0], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0], [40.46, 110.11199999999997, 1.0977999999999994, 2, 2, 0, 1, 0.0, 29.771599999999992, 0]]
19
monooxygenase
Benzene
MTVNSIGEYTATPRDVQANFNGMQLLYLYWEEHLMYCSALAFLVAPGMPFAEFLEQVLKPAIHAHPDSAKIDFSQALWQLNDQPFTPDYAASLEANGIDHKSMLRLNTPGLNGIQGSCS
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
P19733
['C1=CC=C(C=C1)O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'O', 'C1=CC=C(C(=C1)O)O']
[[34.14, 31.998, 0.067, 0, 2, 0, 0, 0.0, 6.734, 0], [20.23, 122.16699999999997, 1.48732, 1, 1, 1, 1, 0.25, 37.101800000000004, 0], [20.23, 122.16699999999999, 1.48732, 1, 1, 1, 1, 0.25, 37.101800000000004, 0], [0.0, 92.14099999999999, 1.99502, 0, 0, 0, 1, 0.14285714285714285, 31.17899999999999, 0], [20.23, 122.16699999999999, 1.48732, 1, 1, 1, 1, 0.25, 37.101800000000004, 0], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]]
20
monooxygenase
Benzene
MDTLRYYLIPVVTACGLIGFYYGGYWVWLGAATFPALMVLDVILPKDFSARKVSPFFADLTQYLQLPLMIGLYGLLVFGVENGRIELSEPLQVAGCILSLAWLSGVPTLPVSHELMHRRHWLPRKMAQLLAMFYGDPNRDIAHVNTHHLYLDTPLDSDTPYRGQTIYSFVISATVGSVKDAIKIEAETLRRKGQSPWNLSNKTYQYVALLLALPGLVSYLGGPALGLVTIASMIIAKGIVEGFNYFQHYGLVRDLDQPILLHHAWNHMGTIVRPLGCEITNHINHHIDGYTRFYELRPEKEAPQMPSLFVCFLLGLIPPLWFALIAKPKLRDWDQRYATPGERELAMAANKKAGWPLWCESELGRVASI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
P21395
['O=O', 'CC1=CC(=CC=C1)CO', 'CC1=CC=CC=C1CO', 'CC1=CC=CC=C1', 'CC1=CC=C(C=C1)CO', 'O']
[[40.46, 247.892, 3.7113999999999994, 2, 2, 0, 1, 0.0, 49.811600000000006, 0], [0.0, 35.453, -2.996, 0, 0, 0, 0, 0.0, 0.0, -1], [364.78999999999996, 744.4170000000003, -2.898899999999998, 9, 18, 13, 3, 0.47619047619047616, 150.28740000000005, 1], [23.79, 27.025999999999996, 0.13978, 0, 1, 0, 0, 0.0, 6.67, 0], [34.14, 245.876, 2.5166, 0, 2, 0, 0, 0.0, 47.478, 0], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]]
21
monooxygenase
Benzene
MSTYPINAPGQSADAAVLIVGGGPTGLIAANELLRRGVSCRMIDRLPVAHQTSKSCTIHARSMEMMEHIGIAARYIETGVRSNGFTFNFENTDANALLDFSVLPGRYPFITIYNQNETERVLRHDLEATYSFQPEWGTQLLALNQDENGIRADLRLKDGTKQTISPRWVIGADGVRSRVRECLGIAYEGEDYEENVLQMMDVGIQDFEAGDDWIHYFIGQDKFVFVTKLPGSNYRVIISDLGGANKSNLEETREAFQGYLSSFDDHATLDEPRWATKWRVWKRMATAYRKGNVFLAGDAAHCHSPSGGSGMNVGMQDAFNLGWKIAMVERGEAKPDLLDTYHTERTPVAQQLLEGTHAMHEIIMGHGKGLTDRIELTQAPGWHDAATYRVSGMSYNYRDQLVSFNDDRLAGPSAGDRIPDAELAPRIRLFDLVRNTRPTLLVAPATEAEVAEAEKLRDLIREQWPLVKPVLVRPQGSEESIEGDVHVDSYGQLKREWGDNAKGWAALLRPDNYIHARAGLDRGDLLVQAIDAMLVRCA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
P42535
['C1(=C(C(=C(C(=C1Cl)Cl)O)Cl)Cl)O', '[Cl-]', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)OP(=O)(O)O)O)O)O)C(=O)N', 'C#N', 'C1(=C(C(=O)C(=C(C1=O)Cl)Cl)Cl)Cl', 'O']
[[318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [20.23, 108.13999999999999, 1.7006199999999996, 1, 1, 0, 1, 0.14285714285714285, 32.843799999999995, 0], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]]
22
monooxygenase
Benzene
MSAFPVHAAFEKDFLVQLVVVDLNDSMDQVAEKVAYHCVNRRVAPREGVMRVRKHRSTELFPRDMTIAESGLNPTEVIDVVFEE
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q00457
['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'CC1=CC=C(C=C1)O', 'O']
[[318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [20.23, 108.13999999999999, 1.7006199999999996, 1, 1, 0, 1, 0.14285714285714285, 32.843799999999995, 0], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]]
23
monooxygenase
Benzene
MSFESKKPMRTWSHLAEMRKKPSEYDIVSRKLHYSTNNPDSPWELSPDSPMNLWYKQYRNASPLKHDNWDAFTDPDQLVYRTYNLMQDGQESYVQSLFDQFNEREHDQMVREGWEHTMARCYSPLRYLFHCLQMSSAYVQQMAPASTISNCCILQTADSLRWLTHTAYRTHELSLTYPDAGLGEHERELWEKEPGWQGLRELMEKQLTAFDWGEAFVSLNLVVKPMIVESIFKPLQQQAWENNDTLLPLLIDSQLKDAERHSRWSKALVKHALENPDNHAVIEGWIEKWRPLADRAAEAYLSMLSSDILPAQYLERSTSLRASILTV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q00460
['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'CC1=CC=C(C=C1)O', 'O']
[[317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0]]
24
monooxygenase
Benzene
MFNIQSDDLLHHFEADSNDTLLSAALRAELVFPYECNSGGCGACKIELLEGEVSNLWPDAPGLAARELRKNRFLACQCKPLSDLKIKVINRAEGRASHPPKRFSTRVVSKRFLSDEMFELRLEAEQKVVFSPGQYFMVDVPELGTRAYSAANPVDGNTLTLIVKAVPNGKVSCALANETIETLQLDGPYGLSVLKTADETQSVFIAGGSGIAPMVSMVNTLIAQGYEKPITVFYGSRLEAELEAAETLFGWKENLKLINVSSSVVGNSEKKYPTGYVHEIIPEYMEGLLGAEFYLCGPPQMINSVQKLLMIENKVPFEAIHFDRFF
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q03304
['C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O']
[[318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [40.46, 110.11199999999997, 1.0977999999999994, 2, 2, 0, 1, 0.0, 29.771599999999992, 0], [0.0, 35.453, -2.996, 0, 0, 0, 0, 0.0, 0.0, -1], [34.14, 44.009, -0.5835, 0, 2, 0, 0, 0.0, 5.007, 0]]
25
monooxygenase
Benzene
MSTPLIAGTGPSAVRQLISNAVQNDPVSGNFRCRRDIFTDAALFDYEMKYIFEQNWVFLAHESQVANPDDYLVSNIGRQPVIITRNKAGDVSAVINACSHRGAELCRRKQGNRSTFTCQFHGWTFSNTGKLLKVKDGQDDNYPEGFNVDGSHDLTRIPSFANYRGFLFGSMNPDACPIEEHLGGSKAILDQVIDQTPGELEVLRGSSSYIYDGNWKLQIENGADGYHVGSVHWNYVATIGRRDRTSDTIRTVDVTTWSKKNIGGTYTFEHGHMLLWTRLPNPEVRPVFARREELKARVGEEVADAIVNQTRNLCIYPNLYVMDQISTQIRVVRPISVDKTEVTIYCFAPRDESEEVRNARIRQYEDFFNVSGMGTPDDLEEFRACQSGYRGSAREWNDLSRGAPHWISGPDDNARRLGLAPLMSGARMEDEGLFVQQHTYWAETMLRGIEAEPKVFNVQPVEVAQ
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q51601
['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'C1=CC=C(C(=C1)O)O', '[Cl-]', 'C(=O)=O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
26
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNIITTEGDAGQCGITATAVCSVTDTPPSLMVCINANSAMNPVFQGNGKLCVNVLNHEQELMARHFAGMTGMAMEERFSLSCWQKGPLAQPVLKGSLASLEGEIRDVQAIGTHLVYLVEIKNIILSAEGHGLIYFKRRFHPVMLEMEAAI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q57501
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[35.0, 17.031, 0.16199999999999998, 1, 1, 0, 0, 0.0, 5.0221, 0], [40.46, 110.11199999999997, 1.0977999999999994, 2, 2, 0, 1, 0.0, 29.771599999999992, 0], [34.14, 44.009, -0.5835, 0, 2, 0, 0, 0.0, 5.007, 0], [364.78999999999996, 744.4170000000003, -2.898899999999998, 9, 18, 13, 3, 0.47619047619047616, 150.28740000000005, 1], [318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1]]
27
monooxygenase
Benzene
MEQTASPVVFAARDDASDVHFPHDDGSRVPYKVFSSRAVYDREQERIFRGPTWNFVALEAEIPNAGDFKSTFVGDTPVVVTRTEDGALSAWVNRCAHRGAQVCRKSRGNASSHTCVYHQWSFDNEGNLLGVPFRRGQKGMTGMPADFDPKQHGLRKLRVDSYRGLVFATFSDDVAPLPDYLGAQMRPWIDRIFHKPIEYLGCTRQYSKSNWKLYMENVKDPYHASMLHLFHTTFNIFRVGMKARSIPDANHGLHSIITVTKTGDDTSAAYKQQNIRSFDEGFHLEDESILDLVSEYDEDCTNHIQPIFPQLVIQQIHNTLVARQILPKGPDNFELIFHFFGYADDTPELRALRIKQANLVGPAGYISMEDTEATELVQRGTVRDADATSVIEMSRGNPEQQDTVITESLIRKFWVGYQKLMGY
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q84BZ3
['N', 'C1=CC=C(C(=C1)O)O', 'C(=O)=O', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)OP(=O)(O)O)O)O)O)C(=O)N', 'C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
28
monooxygenase
Benzene
MSVENEHRLRFRDAMASLSAAVNIVTTDGRAGCCGITATAVCSITDTPPTLMVCINRNSAMNTVFQENGRLCVNILNHEQELMARHFAGMTGVSMEERFRWNIWQKGVLGQPVLTGTLASLEGEIEQVQEVGTHNVYLVQIRHITVSEQGHGLIYFKRNFRPVMLEIEAAAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A2S8PY46
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
29
monooxygenase
Benzene
MSVENEHRLRFRDAMASLSAAVNIVTTDGLAGRCGITATAVCSVTDTPPTLMVCINRKSSMNPVFQENGHLCVNILNHEQELMARHFAGMTDVSMEERFNWDIWRTGVLGQPLLQGALANLEGRIEQVQEVGTHYVYLVEIKQIMVREEGHGLIYFKRGFHPVMDKTVATTV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A068QSC3
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
30
monooxygenase
Benzene
MSVENEHRLRFRNAMASLSAAVNIITTDGPAGRCGITATAVCSVTDTPPTLMVCINRNSAMNPVFQENGRLCVNILNHEQELIARHFAGMTGVSMEERFGWNIWKTGALGQPMLKETLANLEGSIEQIQEIGTHYVYLVEVKQMAVKEEGHGLIYFKRDFHHVMDKSLADAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0B6X5K6
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
31
monooxygenase
Benzene
MSVENEHRLRFRNAMASLSAAVNIITTDGPAGRCGITATAVCSVTDTPPTLMVCINRNSAMNPVFQENGRLCVNILNHEQELIARHFAGMTGVSMEERFNWNIWKTGALGQPMLKETLANLEGSIEQVQEIGTHYVYLVEVKQMAVKEEGHGLIYFKRDFHHVMDKSLADAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A077NQC9
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
32
monooxygenase
Benzene
MSVENEHRLRFRNAMASLSAAVNIITTDGPAGRCGITATAVCSVTDTPPTLMVCINRNSAMNPVFQENGRLCVNILNHEQELIARHFAGMTGVSMEERFGWNIWKTGALGQPMLKETLANLEGSIEQIQEIGTHYVYLVEVKQMAVKEEGHGLIYFKRDFHHVMDKSLADAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0B6X5K6
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
33
monooxygenase
Benzene
MSVENEHRLRFRNAMASLSAAVNIITTDGPAGRCGITATAVCSVTDTPPTLMVCINRNSAMNPVFQENGRLCVNILNHEQELIARHFAGMTGVSMEERFGWNIWKTGVLGQPMLKETLANLEGSIEQIQEIGTHYVYLVEVKQMAVKEEGHGLIYFKRDFHHVMDKSLADAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A077PIL0
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
34
monooxygenase
Benzene
MSVENEHRLRFRNAMASLSAAVNIITTDGPAGRCGITATAVCSVTDTPPTLMVCINRNSAMNPVFQENGRLCVNILNHEQELIARHFAGMTGVSMEERFGWNIWKTGALGQPMLKETLANLEGSIEQIQEIGTHYVYLVEVKQMAVKEEGHGLIYFKRDFHHVMDKSLADAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0B6X5K6
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
35
monooxygenase
Benzene
MSVENEHRLRFRNAMASLSAAVNIITTDGPAGRCGITATAVCSVTDTPPTLMVCINRNSAMNPVFQENGRLCVNILNHEQELIARHFAGMTGVSMEERFGWNIWKTGVLGQPMLKETLANLEGSIEQVQEIGTHYVYLVEVKQMAVKEEGHGLIYFKRDFHHVMDKSLADAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A077QGF1
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
36
monooxygenase
Benzene
MSVENEHRLRFRDAMASLSAAVNIVTTDGPAGCCGITATAVCSITDTPPTLMVCLNRNSTMNVVFQENGRLCVNILNHEQELMARHFAGMTGVSMEERFRWNIWQKGPLGQPVLTGTLASLEGDIEQVQEVGSHNVYLVHIRHITVSEQGHGLIYFKRNFRPVMLETVAAAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A081RZH0
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
37
monooxygenase
Benzene
MHQDEQRLRFRDAMASLSAAVNIITTEGEAGCCGITATAVCSVTDTPPSLMVCINANSAMNPVFQGNGKLCVNVLNHEQELMARHFAGMTGMAMEERFKLGCWQKGLLAQPVLKGALASLEGEISQVQTIGTHLVYLVEIKNIILRGEEGHGLIYFKRRFHPVMLALEAAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A084ZMU9
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
38
monooxygenase
Benzene
MSLENEHRLRFRDAMSSLSAAVNIVTTDGPAGRCGITATAVCSVTDTPPSLMVCINSNSAMNPVFQENGKLCVNVLSHEQELMARHFAGMTGTSMEERFSWDIWTKGILGQPMLRGTLASLEGEIEQVQTIGTHLVYLVQIKQITLSEAGHGLIYFKRHFHPVMLEAVAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0K0HVF5
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
39
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNIITTEGDTGQCGITATAVCSVTDTPPSLMVCINANSAMNPVFQGNGKLCVNVLNHEQELMARHFAGMTGMAMEERFSLSCWQKGPLAQPVLKGSLASLEGEIRDVQAIGTHLVYLVEIKNIILSAEGHGLIYFKRRFHPVMLEMEAAI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0A1AIX3
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
40
monooxygenase
Benzene
MSVENEHRLRFRNAMASLSAAVNIITTDGPAGRCGITATAVCSVTDTPPTLMVCINRNSAMNPVFQENGRLCVNILNHEQELIARHFAGMTGVSMEERFGWNIWKTGALGQPMLKETLANLEGSIEQIQEIGTHYVYLVEVKQMAVKEEGHGLIYFKRDFHHVMDKSLADAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0B6X5K6
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
41
monooxygenase
Benzene
MQVDEQRLRFRDAMASLAAAVNIVTTAGHAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCINVLNHEQELMARHFAGMTGMAMEERFHQPCWQNGPLGQPVLNGALAGLEGEISEVQTIGTHLVYLVAIKNIILSQDGHGLIYFKRRFHPVRLEMEAPV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q8ZQ51
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
42
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNIITTEGNAGQCGITATAVCSVTDTPPSLMVCINANSAMNPVFQGNGKLCVNVLNHEQELMARHFAGMTGMAMEERFSLSCWQKGPLAQPVLKGSLASLEGEIRDVQAIGTHLVYLVEIKNIILSAEGHGLIYFKRRFHPVMLEMEAAI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0D8WC12
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
43
monooxygenase
Benzene
MSTENQHHLCFRDAMACLSAAVNIVTTDGPAGRCGITATAVCSVTDTPPTLIICINRNSAMNPVFQQNGCLCINVLNHQQEPMARHFAGMTGSSMEERFSWDIWNVGLLGQPLLRDTLASLEGVIEQVQTIGTHHTDRSA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0E1NTZ3
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
44
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNVVTTAGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGKLCINVLNHEQEIMARHFAGMTGVTMEERFALSGWQQGALGQPVLKGSLASLEGEISQVQTIGTHLVYLVEIRNITLSPQGHGLIYFKRRFHPVMMEMEVAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0AAU7H2E5
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
45
monooxygenase
Benzene
MQLDEQRLRFREAMASLSAAVNIVTTEGEAGQCGITATAVCSVTDTPPSLMVCINASSAMNPVFRGNGRMCVNVLNHEQELMARHFAGMTGMAMAERFSQSCWQRGPLKQPVLKGALASLEGRISQVQTIGTHLVYLVEIENIILSDDGHGLIYFRRQFHPVMLAAETA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0F0V6D9
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
46
monooxygenase
Benzene
MQSEQRLRFRDAMASLSAAVNVVTTEGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCVNVLNHEQEIMARHFAGMTVMAMEERFALSCWQKGPLAQPVLKGALASLEGEISQVQTIGTHLVYLVEIKNIILSDAGHGLIYFRRRFHPVMLETEVAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0F1AJ88
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
47
monooxygenase
Benzene
MQSEERLRFRDAMASLSAAVNVVTTEGDAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGKLCVNVLNHEQEIMARHFAGMTGMAMEERFALSCWQKGPLAQPVLKGALASLEGEITQVQTIGTHLVYLVEIKNIILSSEGHGLIYFKRRFHPVMMEMEAAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0AAU6NMH5
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
48
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNIITTEGDAGQCGITATAVCSITDTPPSLMVCINANSAMNPVFQGNGKLCVNVLNHEQELMARHFAGMTGMAMEERFSLSCWQKGPLAQPVLKGSLASLEGEIRDVQAIGTHLVYLVEIKNIILSAEGHGLIYFKRRFHPVMLEMEAAI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0F3VIQ8
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
49
monooxygenase
Benzene
MQVDEQRLRFRDAMASLAAAVNIVTTAGHAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCINVLNHEQELMARHFAGMTGMAMEERFHQPCWQNGPLGQPVLNGALAGLEGEISEVQTIGTHLVYLVAIKNIILSQDGHGLIYFKRRFHPVRLEMEAPV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q8ZQ51
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
50
monooxygenase
Benzene
MSVENEHRLRFRDAMASLSAAVNIVTTDGPAGCCGITATAVCSITDTPPTLMVCLNRNSAMNVVFQENGRLCVNILNHEQELMARHFAGMTGVSMEERFRWNIWQKGPLGQPVLTGTLASLEGEIEQVQEVGSHNVYLVHIRHITVSEQGHGLIYFKRNFRPVMLETVAAAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0F7LR03
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
51
monooxygenase
Benzene
MSQENEQRLRFRDAMASLSAAVNIITTDGPAGRCGITATAVCSVTDTPPTLLVCINRNSAMNPVFQENRRLCVNVLNHEQELMARHFAGMTGVSMEDRFRLEEWQLGALGQPVLRNTLASLEGEIEQIQSIGTHQMYLVQIKQIALSEAGNGLIYFKRNFHSVIHPMAVPA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0G3SLF8
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
52
monooxygenase
Benzene
MSEEKQANPLFRDAMASLGAAVNIVATNGDAGCCGLTATAVCSVTDNPPTVMVCINSKSQMNSIFQENGKLSINILNHEQEEMACHFAGMTGLAMADRFTQPGWQNGQLQQPVLTNALACLEGDIHDVRQIGTHFVYMTEIKTISVREDGDGLIYFKRRFHSVKNKQVPIPA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0G4Q6Q7
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
53
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNIITTEGDAGQCGITATAVCSVTDTPPSLMVCINANSAMNPVFQGNGNLCVNVLNHEQELMARHFAGMTGMAMEERFSLSCWQKGPLAQPVLKGSLASLEGEIRDVQAIGTHLVYLVEIKNIILSAEGHGLIYFKRRFHPVMLEMEAAI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0H0QEV0
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
54
monooxygenase
Benzene
MQLDEQRLRFHDAMASLSAAVNIITTEGDAGQCGITATAVCSVTDTPPSLMVCINANSAMNPVFQGNGKLCVNVLNHEQELMARHFAGMTGMAMEERFSLSCWQKGPLAQPVLKGSLASLEGEIRDVQAIGTHLVYLVEIKNIILSAEGHGLIYFKRRFHPVMLEMEAAI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A3T6J3P7
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
55
monooxygenase
Benzene
MQVDEQRLRFRDAMASLAAAVNIVTTAGHAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCINVLNHEQELMARHFAGMTGMAMEERFHQPCWQNGPLGQPVLNGALAGLEGEISEVQTIGTHLVYLVAIKNIILSQDGHGLIYFKRRFHPVRLEMEAPV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q8ZQ51
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
56
monooxygenase
Benzene
MSTENQHHLCFRDAMACLSAAVNIVTTDGPAGRCGITATAVCSVTDTPPTLIICINRNSAMNPVFQQNGCLCINVLNHQQEPMARHFAGMTGSSMEERFSWDIWNVGLLGQPLLRDTLASLEGVIEQVQTIGTHLVYLVHITQIVLREQGHGLIYFKRHFHPVMV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0H3B3U4
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
57
monooxygenase
Benzene
MSTENQHHLCFRDAMACLSAAVNIVTTDGPAGRCGITATAVCSVTDTPPTLIICINRNSAMNPVFQQNGCLCINVLNHQQEPMARHFAGMTGSSMEERFSWDIWNVGLLGQPLLRDTLASLEGVIEQVQTIGTHLVYLVHITQIVLREQGHGLIYFKRHFHPVMV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0H3B3U4
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
58
monooxygenase
Benzene
MQVDEQRLRFRDAMASLAAAVNIVTTAGHAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGKLCINVLNHEQELMARHFAGMTGMAMEERFHQPCWQNGPLGQPVLNGALAGLEGEISEVQTIGTHLVYLVAIKNIILSQDGHGLIYFKRRFHPVRLEMEAPV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A8E6XAP8
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
59
monooxygenase
Benzene
MHSDEQRLRFRDAMASLSAAVNVITTAGDAGRCGITATAVCSVTDSPPSVMVCINANSAMNPVFQGNGKLCVNVLNHEQEIMARHFAGMTGMAMEERFTLSCWQKGPLAQPVLKGALASLEGEISQVQTIGTHLVYLVEIKNIILSEEGHGLIYFKRRFHPVMMEPEAAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A7V7JFS3
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
60
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNVVTTAGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGKLCINVLNHEQEIMARHFAGMTGVTMEERFALSGWQQGALGQPVLKGSLASLEGEISQVQTIGTHLVYLVEIRNITLSPQGHGLIYFKRRFHPVMMEMEVAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0AAU7H2E5
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
61
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNVVTTAGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGKLCINVLNHEQEIMARHFAGMTGVTMEERFALSGWQQGALGQPVLKGSLASLEGEISQVQTIGTHLVYLVEIRNITLSPQGHGLIYFKRRFHPVMMEMEVAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0AAU7H2E5
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
62
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNVITTEGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGKLCINVLNHEQEEMARHFAGMTGMTMDDRFGLSGWQKGALGQPVLKGALASLEGEISQVQTIGSHLVYLVEIRNITLSQQGHGLIYFKRRFHPVMMEMDVVA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A285AY39
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
63
monooxygenase
Benzene
MQVDEQRLRFRDAMASLAAAVNIVTTAGHAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCINVLNHEQELMARHFAGMTGMAMEERFHQPCWQNGPLGQPVLNGALAGLEGEISEVQTIGTHLVYLVAIKNIILSQDGHGLIYFKRRFHPVRLEMEAPV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q8ZQ51
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
64
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNIITTEGDAGQCGITATAVCSVTDTPPSLMVCINANSAMNPVFQGNGKLCVNVLNHEQELMARHFAGMTGMAMEERFSLSCWQKGPLAQPVLKGSLASLEGEIRDVQAIGTHLVYLVEIKNIILSAEGHGLIYFKRRFHPVMLEMEAAI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q57501
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
65
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNVITTEGEAGRCGITATAVCSVTDTPPSLMVCINGNSAMNPVFQGNGKLCINVLNHEQEVMARHFAGMTGMAMEDRFNLSCWQKGTLGQPVLKGSLASLEGEISQVQTIGSHLVYLVEIRNITLGQQGHGLIYFKRRFHPVKMEMEMVV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0J1LUU6
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
66
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNVITTEGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGKLCINVLNHEQEEMARHFAGMTGMTMDDRFGLSGWQKGALGQPVLKGALASLEGEISQVQTIGSHLVYLVEIRNITLSQQGHGLIYFKRRFHPVMMEMDVVA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A285AY39
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
67
monooxygenase
Benzene
MSVENEHRLRFRDAMASLSAAVNIITTDGPAGRCGMTATAVCSVTDTPPTLMVCINRNSAMNPVFQENGNLCINILNHEQELMARHFAGMTGVSMEDRFKWNIWNTGVLGQPQLQETLANLEGRIEQVQEVGTHYVYLVEIKQIIVQEKGHGLIYFKRGFHPVMDENMAITA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0J5FXT6
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
68
monooxygenase
Benzene
MQRDEQRLRFRDAMASLAAAVNIVTTAGHAGRCGITATAVCSVTDTPPSVIVCINANSAMNPVFQGNGRLCINVLNHEQELMARHFAGMTGMAMEERFHQPCWQNGPLGQPVLNGALAGLEGEISEVQTIGTHLVYLVAIKNIILSQDGHGLIYFKRRFHSVKLEMETPI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
S5MUF3
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
69
monooxygenase
Benzene
MSLENEHRLRFRDAMSSLSAAVNIVTTDGPAGRCGITATAVCSVTDTPPSLMVCINSNSAMNPVFQENGKLCVNVLSHEQELMARHFAGMTGTSMEERFSWDIWTKGILGQPMLRGTLASLEGEIEQVQTIGTHLVYLVQIKQITLSEAGHGLIYFKRHFHPVMLEAVAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0K0HVF5
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
70
monooxygenase
Benzene
MHQDEQRLRFRDAMASLSAAVNIVTTEGDAGCCGITATAVCSVTDTPPSLMVCINANSAMNPVFQGNGKLCVNVLNHEQELMARHFAGMTGMAMEERFKLACWQKGVLAQPVLKGALASLEGEISQVQTIGTHLVYLVEIKNIILRGEEGHGLIYFKRRFHPVMLALEAAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0L0GMK7
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
71
monooxygenase
Benzene
MQVDEQRLRFRDAMASLAAAVNIVTTAGHAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGKLCINVLNHEQELMARHFAGMTGMAMEERFHQPCWQNGPLGQPVLNGALAGLEGEISEVQTIGTHLVYLVAIKNIILSQDGHGLIYFKRRFHPVRLEMEAPV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A8E6XAP8
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
72
monooxygenase
Benzene
MSVENKHRLRFRDAMASLSAAVNIITTDGPAGRCGMTATAVCSVTDTPPTLMVCINRDSAMNPVFQENGHLCVNILDHEQELMARHFAGMTGISMEERFNWDIWKTGILGQPLLQGALANLEGCIKQVQEVGTHYVYLVEIKQILVREEGHGLIYFKRNFHPVMDKNMAAVV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0M0T9Q4
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
73
monooxygenase
Benzene
MSLENEHRLRFRDAMSSLSAAVNIVTTDGDAGCCGITATAVCSVTDTPPTLMVCINRNSSMNAVFQENGRLCVNILNHQQEEMACHFAGMTGTSMEERFSWDIWSQGILNQPLLKEALANLEGEITQVQEVGTHYVYLVEMKQIIVRDEGHGLIYFKRKFHPVIHQQLQVAI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0N0Z8M9
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
74
monooxygenase
Benzene
MQVDEQRLRFRDAMASLAAAVNIVTTAGHAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCINVLNHEQELMARHFAGMTGMAMEERFHQPCWQNGPLGQPVLNGALAGLEGEISEVQTIGTHLVYLVAIKNIILSQDGHGLIYFKRRFHPVRLEMEAPV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q8ZQ51
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
75
monooxygenase
Benzene
MSQENEQRLRFRDAMASLSAAVNIVTTDGPAGRCGITATAVCSVTDTPPTLLVCINRNSAMNPVFQENRRLCVNVLNHEQELMARHFAGMTGVSMEDRFRLEEWQLGALGQPVLRNTLASLEGEIEQIQSIGTHQMYLVQIKQIALSEAGNGLIYFKRNFHSVIHQMAVPA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0P0QAC4
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
76
monooxygenase
Benzene
MQSEERLRFRDAMASLSAAVNVVTTEGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCINVLNHEQEIMARHFAGMTGMTMEERFALSCWQKGPLAQPMLKGALASLEGEISQVQTIGTHLVYLVEIKNIILSDAGHGLIYFKRRFHPVMMEVEATA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A6N3DRB8
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
77
monooxygenase
Benzene
MYSEEQHRLNFREAMASLPAAVNIVTTQGSAGRCGITATAVCSVTDTPPTLLVCINSRSAMNPVFTGNGRMCVNVLNHQQEEMARHFAGMTELSMEQRFGLEGWREGELQQPVLQRALASLEGEIQQINTIGTHRVYLLEVRHIALATQGSGLIYFKRQFHATPYQQKLVTV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0Q4MHA6
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
78
monooxygenase
Benzene
MQVDEQRLRFRDAMASLAAAVNIVTTAGHAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGKLCINVLNHEQELMARHFAGMTGMAMEERFHQPCWQNGPLGQPVLNGALAGLEGEISEVQTIGTHLVYLVAIKNIILSQDGHGLIYFKRRFHPVRLEMEAPV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A8E6XAP8
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
79
monooxygenase
Benzene
MQVDEQRLRFRDAMASLAAAVNIVTTAGHAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCINVLNHEQELMARHFAGMTGMAMEERFHQPCWQNGPLGQPVLNGALAGLEGEISEVQTIGTHLVYLVAIKNIILSQDGHGLIYFKRRFHPVRLEMEAPV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q8ZQ51
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
80
monooxygenase
Benzene
MSTENQHHLCFRDAMACLSAAVNIVTTDGPAGRCGITATAVCSVTDTPPTLIICINRNSAMNPVFQQNGCLCINVLNHQQEPMARHFAGMTGSSMEERFSWDIWNVGLLGQPLLRDTLASLEGVIEQVQTIGTHLVYLVHITQIVLREQGHGLIYFKRHFHPVMV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0H3B3U4
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
81
monooxygenase
Benzene
MQVDEQRLRFRDAMASLAAAVNIVTTAGHAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCINVLNHEQELMARHFAGMTGMAMEERFHQPCWQNGPLGQPVLNGALAGLEGEISEVQTIGTHLVYLVAIKNIILSQDGHGLIYFKRRFHPVRLEMEAPV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
Q8ZQ51
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
82
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNVVTTAGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGKLCINVLNHEQEIMARHFAGMTGVTMEERFALSGWQQGALGQPVLKGSLASLEGEISQVQTIGTHLVYLVEIRNITLSPQGHGLIYFKRRFHPVMMEMEVAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0AAU7H2E5
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
83
monooxygenase
Benzene
MQSEQRLRFRDAMASLSAAVNVVTTEGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCVNVLNHEQEIMARHFAGMTGMAMEERFALSCWQKGPLAQPVLKGALASLEGEISQVQTIGTHLVYLVEVKNIILSDAGHGLIYFKRRFHPVMLETEVAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A0X4EDQ9
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
84
monooxygenase
Benzene
MSQENEHRLRFRDAMASLSAAVNIVTTSGPAGRCGITATAVCSVTDTPPSLMVCINRNSAMNPVFQENGRLCVNVLNHEQEMMARHFAGMTDVSMEERFLLDEWQTGALGQPMLRHSLASLEGEVTQVQSIGTHQMYLVEIKQITLSDGGHGLIYFKRNFHPVMHQMAALA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A140F1H7
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
85
monooxygenase
Benzene
MSLENEHRLRFRDAMASLGAAVNIVTTDGTAGCCGITATAVCSVTDTPPTLMVCVNRNSAMNAVFQENGRLCVNILNHEQEEMACHFAGMKGSTMEERFAWSIWDKGILQQPLLKDALANLEGEITQVQDIGTHSVYLVEMKQIIVREEGHGLIYFKRKFHPVMHQTLAVTA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0AA86YEU2
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
86
monooxygenase
Benzene
MHLDEQRLRFRDAMSSLSAAVNVITTEGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCVNVLNHEQEIMARHFAGMTGMTMEERFTLSCWQKGPLAQPVLKGALASLEGEISQVQTIGTHLVYLVEIKNIILSEEGHGLIYFKRRFHPVMLEAEAAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A144DW46
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
87
monooxygenase
Benzene
MHSDEQRLRFRDAMSSLSAAVNVVTTEGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGRLCVNVLNHEQEIMARHFAGMTGMTMEDRFALSCWQKGPLAQPVLKGALASLEGEISQVQTIGTHLVYLVEIKNIILSDAGHGLIYFRRRFHPVMLETEVAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A156JC63
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
88
monooxygenase
Benzene
MSEEKQASPLFRDAMASLGAAVNIVATDGKAGCCGLTATAVCSVTDNPPTVMICINSKSQMNAIFQENGKLSINILNHEQEEMACHFAGMTGLAMAERFTQPGWQRGQQQQPILINALASLEGDIYDVRQVGTHFVYMTEIKNITVREDGHALIYFKRRFHSVKNEQIITTV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A198FJV2
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[17.07, 200.26199999999997, 2.8337000000000003, 0, 1, 0, 2, 0.0, 56.55240000000003, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0], [34.14, 216.26099999999997, 2.4998000000000005, 0, 2, 0, 2, 0.0, 57.32980000000003, 0]]
89
monooxygenase
Benzene
MKSLALNPRLAETLERIGGQIAENGEAAEQAERFSEENYALLQQEKIFSALVPEALGGAGHGYRDLCSFLRELAALHPSTALACSMHQHIVAANRYNHLNGRPGQAVLEKVAARELVLVSTGAGDWLASNGQLEKTEGGFIFNGVKHFASGSPAGDVLVTSAPYEDPAQGWQVLHFPVPLGTEGVKVLDNWTPLGMRGSGSNSVSLENVFVPEASIVVRRPRGDFHLMWCVVLPVALPLIMSVYYGTAREAARRTRDLCRSSLDPVTPYLLGEMENALTCAEVALNSMIDIVDEFGFSADLATVNEVVKRKTLVAEACKGVTAKALEASGGRGFMRGNGIENLLRDVMASHFHPLQEKRQHLFTGSLAMGKEPPTQAF
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A1A9F0K0
['C1=CC=C2C(=C1)C3=CC=CC=C3S2=O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'O', 'C1=CC=C2C(=C1)C3=CC=CC=C3S2(=O)=O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
90
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNVVTTEGEAGRCGITATAVCSVTDSPPSVMVCINANSAMNPVFQGNGKLCINVLNHEQEIMARHFAGMTGMAMDERFNLAGWQRGALGQPVLKAALACLEGEIRQVQTIGSHLVYLVEVQHIALAEEEGHGLIYFKRRFHPVMMEAEALA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A1B7JJ96
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
91
monooxygenase
Benzene
MSLENEHRLRFRDAMASLGAAVNIVTTDGTEGCCGITATAVCSVTDTPPTLMVCVNRNSAMNAVFQKNGRLCVNVLSHDQEEMACHFAGMKGSTMEERFGWNVWDKGILQQPQLKNALANLEGEITQVQDIGTHSVYMVEMKQIIVNDTGHGLVYFKRKFHPVMHQILETTE
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A1B7JPB3
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
92
monooxygenase
Benzene
MSFDNSRCLQFRDAMANLSAAVNIVTTDGEAGRAGLTATAVCSVTDNPPTLLVCINRSSALSEVFKTNGRLCVNVLTHTHQALACDFAGMTGLSMDARFSGDNWQSGQLGQPCLNNSLASLEGTVTQVQEIGTHNVFMVEIENVDVCDRGHGLIYFKRDFRVIETSETLSSAVA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A1B8HA93
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
93
monooxygenase
Benzene
MSFDNSRCLQFRDAMANLSAAVNIVTTDGEAGRAGLTATAVCSVTDNPPTLLVCINRSSALSEVFKTNGRLCVNVLTHSHQALACDFAGMTGLSMDARFSGDNWQSGQLGQPCLNNALASLEGAVTQVQEIGTHNVFMVEIENIDVRDRGHGLIYFKRDFRVVETSEPLSSAVA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A1B8HB98
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
94
monooxygenase
Benzene
MSLENEHRLRFRDAMASLGAAVNIVTTDGTEGRCGITATAVCSVTDTPPTLMVCVNRNSAMNAVFQKNGRLCVNVLSHDQEELACHFAGMKGSTMEERFSWNVWEKGLLQQPQLKGSLANLEGEITQVQDIGTHSVYMVEMKQIIVNDTGHGLVYFKRKFHPVMHQILEPTA
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0AA97BLQ4
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
95
monooxygenase
Benzene
MSVENEHRLRFRDAMASLSAAVNIVTTDGRAGCCGITATAVCSITDTPPTLMVCINRNSAMNTVFQENGRLCVNILNHEQELMARHFAGMTGVSMEERFRWNIWQTGVLGQPVLTGTLASLEGEIEQVQEVGTHNVYLVQIRHITASEQGHGLIYFKRNFRPVMLEIEAAAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A1B8YEW5
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
96
monooxygenase
Benzene
MSVENEHRLRFRDAMASLSAAVNIVTTDGNAGCCGITATAVCSITDSPPTLMVCLNRNSAMNVVFQENGHLCVNILNHEQELMARHFAGMTGVSMEERFRWNIWQKGVLGQPVLTGTLASLEGEIEQVQEIGTHNVYLVQIKHITVSEQGHGLIYFKRNFRPVMLETAAAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A1C0U9U1
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
[[31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]]
97
monooxygenase
Benzene
MTNGFRRQGAVDRLFSGACRALAALSGAAPAARPMPVAGGDPTEPAGPAERRLSGALMRVNHVGEICAQALYEGQAAATSDPRLADEFRQAAREEGDHLAWTRERLRELDARPSLLNPLWYGGALLLGLVAGRAGDRLSLGFMAETERQVEAHLAGHLERLPASDLRSRAIVVAMKDDEIRHAQNALRLGGAELPAPVRGAMRAAAKVMTATAHYI
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A1D2SCX9
['O']
[[0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [161.56, 376.369, -1.7235599999999995, 5, 9, 5, 1, 0.4117647058823529, 95.62090000000002, 0], [317.62, 665.4460000000001, -2.6863999999999955, 8, 18, 11, 2, 0.5238095238095238, 141.84660000000002, 0], [208.08999999999997, 456.34800000000007, -1.6065600000000007, 6, 10, 7, 1, 0.4117647058823529, 106.53120000000001, 0], [362.93, 785.5570000000001, -2.423959999999997, 9, 21, 13, 3, 0.4444444444444444, 176.8336999999998, 0]]
98
monooxygenase
Benzene
MQLDEQRLRFRDAMASLSAAVNVVTTEGEAGRCGITATAVCSVTDTPPSVMVCINANSAMNPVFQGNGKLCINVLNHEQEIMARHFAGMTGVTMEERFALSGWQQGALGQPVLKGSLASLEGEISQVQTIGTHLVYLVEIRNITLSPQGHGLIYFKRRFHPVMMEMEVAV
[0.0, 78.11399999999999, 1.6866, 0, 0, 0, 1, 0.0, 26.441999999999993, 0]
C1=CC=CC=C1
A0A9Q8BQ43
['[H+]', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](CO)O)O)O', 'C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O', 'CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O']
End of preview. Expand in Data Studio
README.md exists but content is empty.
Downloads last month
48
Size of downloaded dataset files:
9.39 MB
Size of the auto-converted Parquet files:
2.27 MB
Number of rows:
9,044