system_id
stringlengths
17
57
split
stringclasses
1 value
entry_pdb_id
stringlengths
4
4
entry_determination_method
stringclasses
8 values
entry_resolution
float32
0.64
37
is_experimental
bool
1 class
protein_sequence
stringlengths
2
5.16k
protein_chain_id
stringclasses
455 values
protein_instance_chain
stringlengths
3
5
ligand_smiles
stringlengths
2
604
ligand_ccd_code
stringlengths
1
135
ligand_instance_chain
stringlengths
3
5
ligand_is_proper
bool
2 classes
ligand_is_covalent
bool
2 classes
ligand_molecular_weight
float32
7.02
3.45k
system_pass_validation_criteria
bool
2 classes
system_num_protein_chains
int32
1
5
system_num_ligand_chains
int32
1
5
8uhe__1__1.F_1.K__1.Y
train
8uhe
ELECTRON MICROSCOPY
null
true
MTDRTNGGSPVVHPQQYHTVPTAVINGAHQRDRYPNHSEMQTLSTFLRTGLQRLEIAQTLAQHANEIVAAGGKRIFVGGNPMAYFEQPEELVGMPGSGYFVAEDYLSPKSRRQTGNGHSVQNSSSSITNPVAWLKGLFFSGKPSVPSRFQAINIADYGAVRMKRSMRDLGWFLRYITYAVVAGDTSIITVNTRGLRGIIPEDVTVATTVALQEMQWKSLSFFPVDSAAAALVRRYFDVLIADYQVEKPSDRYRTGVSKHDQGLSFPESYEDSGCAIPRWVMKPTLPDSEKDAVIRAAYRQVFERDISGLGTAELTQPISQ...
K
1.K
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.Y
true
true
588.2948
false
2
1
8uhe__1__1.G_1.L__1.Z
train
8uhe
ELECTRON MICROSCOPY
null
true
MSLVTELILSADSEARYPAPKELRIFQDFVKTGEQRVRIAKALAANEERIVQNGSQKFWERCPNTPSNSGVDRKTASCQRDQGWYVRLIAYSILAGSERPLEDIGTVGIKEMYNNLEIPIRNIAECMRCLKEEAMAVLSDEDAQEVAAYFDLIIQSLS
G
1.G
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.Z
true
true
588.2948
false
2
1
8uhe__1__1.G_1.L__1.Z
train
8uhe
ELECTRON MICROSCOPY
null
true
MQDAITTLINTSDAQGKYLDDSSLDTLQEYFRSGDLRAKAAMTISANASTIVTKTVAKSLLYTDITGPGGNMYTCRRYAACIRDMDFFLRYGTYAMLAGDASILDERVLNGLKETYNSLGVPVGATIRAVQAMKEVVNDMLGAEAGKEVGYYFDHICSGLS
L
1.L
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.Z
true
true
588.2948
false
2
1
8uhe__1__1.K_1.N__1.HA
train
8uhe
ELECTRON MICROSCOPY
null
true
MTDRTNGGSPVVHPQQYHTVPTAVINGAHQRDRYPNHSEMQTLSTFLRTGLQRLEIAQTLAQHANEIVAAGGKRIFVGGNPMAYFEQPEELVGMPGSGYFVAEDYLSPKSRRQTGNGHSVQNSSSSITNPVAWLKGLFFSGKPSVPSRFQAINIADYGAVRMKRSMRDLGWFLRYITYAVVAGDTSIITVNTRGLRGIIPEDVTVATTVALQEMQWKSLSFFPVDSAAAALVRRYFDVLIADYQVEKPSDRYRTGVSKHDQGLSFPESYEDSGCAIPRWVMKPTLPDSEKDAVIRAAYRQVFERDISGLGTAELTQPISQ...
K
1.K
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.HA
true
false
588.2948
false
2
1
8uhe__1__1.K_1.N__1.HA
train
8uhe
ELECTRON MICROSCOPY
null
true
MQDAITTLINTSDAQGKYLDDSSLDTLQEYFRSGDLRAKAAMTISANASTIVTKTVAKSLLYTDITGPGGNMYTCRRYAACIRDMDFFLRYGTYAMLAGDASILDERVLNGLKETYNSLGVPVGATIRAVQAMKEVVNDMLGAEAGKEVGYYFDHICSGLS
N
1.N
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.HA
true
false
588.2948
false
2
1
8uh9__1__1.A_2.A__2.B
train
8uh9
X-RAY DIFFRACTION
2.067
true
SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDVVYCPRHVICTSEDMLNPNYEDLLIRKSNHNFLVQAGNVQLRVIGHSMQNCVLKLKVDTANPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNFTIKGSFLNGSCGSVGFNIDYDCVSFCYMHHMVLPTGVHAGTDLEGNFYGPFVDRQTAQAAGTDTTITVNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQDHVDILGPLSAQTGIAVLDMCASLKELLQNGMNGRTILGSALLEDEFTPFDVVRQCSGVTFQ
A
1.A
CC(C)(C)[C@H](NC(=O)C(F)(F)F)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@@H](C[C@@H]1CCNC1=O)[C@H](O)c1nc3cc(F)ccc3s1)C2(C)C
WOK
2.B
true
true
655.245178
true
2
1
8uhe__1__1.D_1.S__1.W
train
8uhe
ELECTRON MICROSCOPY
null
true
MQDAITTLINTSDAQGKYLDDSSLDTLQEYFRSGDLRAKAAMTISANASTIVTKTVAKSLLYTDITGPGGNMYTCRRYAACIRDMDFFLRYGTYAMLAGDASILDERVLNGLKETYNSLGVPVGATIRAVQAMKEVVNDMLGAEAGKEVGYYFDHICSGLS
D
1.D
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.W
true
true
588.2948
false
2
1
8uhe__1__1.D_1.S__1.W
train
8uhe
ELECTRON MICROSCOPY
null
true
MRMFRVTACVPSQTRIRTQRELQNTYFTKLVPYDNWFKEQQRIQKMGGTIVKVELATGRRGANTGLA
S
1.S
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.W
true
true
588.2948
false
2
1
8uhe__1__1.H_1.I_1.J_1.K__1.BA
train
8uhe
ELECTRON MICROSCOPY
null
true
MQDAITTLINTSDAQGKYLDDSSLDTLQEYFRSGDLRAKAAMTISANASTIVTKTVAKSLLYTDITGPGGNMYTCRRYAACIRDMDFFLRYGTYAMLAGDASILDERVLNGLKETYNSLGVPVGATIRAVQAMKEVVNDMLGAEAGKEVGYYFDHICSGLS
H
1.H
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.BA
true
false
588.2948
false
4
1
8uhe__1__1.H_1.I_1.J_1.K__1.BA
train
8uhe
ELECTRON MICROSCOPY
null
true
MSVISQVIATADREVRYLSKGELDAINRFFNNGPQRLRIVSILNSNAEEIVEKGARRFWQRCPITPSNSDNQQFQASCLRDQAWFIRLISYAVAVGDVDPLEASGVRGVREMYLSLEVPLRSVALCMRSLKEVTLAMLSREDAAEVGPYFDYLIAGLMP
I
1.I
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.BA
true
false
588.2948
false
4
1
8uhe__1__1.H_1.I_1.J_1.K__1.BA
train
8uhe
ELECTRON MICROSCOPY
null
true
MRDTVTSLISNYDTTGRYLDRDAIDSLQSYFITGANRVKVAAMISANAAEISREAGKKLFEVVPELIRPGGNAYTTRRYAACLRDMDYYLRYSSYALVAGNNDVLMERVLQGLRETYNSLGVPIAPTVQGIQIMKEMVKERASDMGVDDTSFIDQPFDFISREVSEISV
J
1.J
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.BA
true
false
588.2948
false
4
1
8uhe__1__1.H_1.I_1.J_1.K__1.BA
train
8uhe
ELECTRON MICROSCOPY
null
true
MTDRTNGGSPVVHPQQYHTVPTAVINGAHQRDRYPNHSEMQTLSTFLRTGLQRLEIAQTLAQHANEIVAAGGKRIFVGGNPMAYFEQPEELVGMPGSGYFVAEDYLSPKSRRQTGNGHSVQNSSSSITNPVAWLKGLFFSGKPSVPSRFQAINIADYGAVRMKRSMRDLGWFLRYITYAVVAGDTSIITVNTRGLRGIIPEDVTVATTVALQEMQWKSLSFFPVDSAAAALVRRYFDVLIADYQVEKPSDRYRTGVSKHDQGLSFPESYEDSGCAIPRWVMKPTLPDSEKDAVIRAAYRQVFERDISGLGTAELTQPISQ...
K
1.K
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.BA
true
false
588.2948
false
4
1
8uhe__1__1.K_1.L__1.FA
train
8uhe
ELECTRON MICROSCOPY
null
true
MTDRTNGGSPVVHPQQYHTVPTAVINGAHQRDRYPNHSEMQTLSTFLRTGLQRLEIAQTLAQHANEIVAAGGKRIFVGGNPMAYFEQPEELVGMPGSGYFVAEDYLSPKSRRQTGNGHSVQNSSSSITNPVAWLKGLFFSGKPSVPSRFQAINIADYGAVRMKRSMRDLGWFLRYITYAVVAGDTSIITVNTRGLRGIIPEDVTVATTVALQEMQWKSLSFFPVDSAAAALVRRYFDVLIADYQVEKPSDRYRTGVSKHDQGLSFPESYEDSGCAIPRWVMKPTLPDSEKDAVIRAAYRQVFERDISGLGTAELTQPISQ...
K
1.K
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.FA
true
false
588.2948
false
2
1
8uhe__1__1.K_1.L__1.FA
train
8uhe
ELECTRON MICROSCOPY
null
true
MQDAITTLINTSDAQGKYLDDSSLDTLQEYFRSGDLRAKAAMTISANASTIVTKTVAKSLLYTDITGPGGNMYTCRRYAACIRDMDFFLRYGTYAMLAGDASILDERVLNGLKETYNSLGVPVGATIRAVQAMKEVVNDMLGAEAGKEVGYYFDHICSGLS
L
1.L
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.FA
true
false
588.2948
false
2
1
8uhe__1__1.K_1.P__1.JA
train
8uhe
ELECTRON MICROSCOPY
null
true
MTDRTNGGSPVVHPQQYHTVPTAVINGAHQRDRYPNHSEMQTLSTFLRTGLQRLEIAQTLAQHANEIVAAGGKRIFVGGNPMAYFEQPEELVGMPGSGYFVAEDYLSPKSRRQTGNGHSVQNSSSSITNPVAWLKGLFFSGKPSVPSRFQAINIADYGAVRMKRSMRDLGWFLRYITYAVVAGDTSIITVNTRGLRGIIPEDVTVATTVALQEMQWKSLSFFPVDSAAAALVRRYFDVLIADYQVEKPSDRYRTGVSKHDQGLSFPESYEDSGCAIPRWVMKPTLPDSEKDAVIRAAYRQVFERDISGLGTAELTQPISQ...
K
1.K
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.JA
true
false
588.2948
false
2
1
8uhe__1__1.K_1.P__1.JA
train
8uhe
ELECTRON MICROSCOPY
null
true
MQDAITTLINTSDAQGKYLDDSSLDTLQEYFRSGDLRAKAAMTISANASTIVTKTVAKSLLYTDITGPGGNMYTCRRYAACIRDMDFFLRYGTYAMLAGDASILDERVLNGLKETYNSLGVPVGATIRAVQAMKEVVNDMLGAEAGKEVGYYFDHICSGLS
P
1.P
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.JA
true
false
588.2948
false
2
1
8uhe__1__1.K_1.R__1.LA
train
8uhe
ELECTRON MICROSCOPY
null
true
MTDRTNGGSPVVHPQQYHTVPTAVINGAHQRDRYPNHSEMQTLSTFLRTGLQRLEIAQTLAQHANEIVAAGGKRIFVGGNPMAYFEQPEELVGMPGSGYFVAEDYLSPKSRRQTGNGHSVQNSSSSITNPVAWLKGLFFSGKPSVPSRFQAINIADYGAVRMKRSMRDLGWFLRYITYAVVAGDTSIITVNTRGLRGIIPEDVTVATTVALQEMQWKSLSFFPVDSAAAALVRRYFDVLIADYQVEKPSDRYRTGVSKHDQGLSFPESYEDSGCAIPRWVMKPTLPDSEKDAVIRAAYRQVFERDISGLGTAELTQPISQ...
K
1.K
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.LA
true
false
588.2948
false
2
1
8uhe__1__1.K_1.R__1.LA
train
8uhe
ELECTRON MICROSCOPY
null
true
MQDAITTLINTSDAQGKYLDDSSLDTLQEYFRSGDLRAKAAMTISANASTIVTKTVAKSLLYTDITGPGGNMYTCRRYAACIRDMDFFLRYGTYAMLAGDASILDERVLNGLKETYNSLGVPVGATIRAVQAMKEVVNDMLGAEAGKEVGYYFDHICSGLS
R
1.R
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.LA
true
false
588.2948
false
2
1
8uhe__1__1.N_1.O__1.IA
train
8uhe
ELECTRON MICROSCOPY
null
true
MQDAITTLINTSDAQGKYLDDSSLDTLQEYFRSGDLRAKAAMTISANASTIVTKTVAKSLLYTDITGPGGNMYTCRRYAACIRDMDFFLRYGTYAMLAGDASILDERVLNGLKETYNSLGVPVGATIRAVQAMKEVVNDMLGAEAGKEVGYYFDHICSGLS
N
1.N
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.IA
true
false
588.2948
false
2
1
8uhe__1__1.N_1.O__1.IA
train
8uhe
ELECTRON MICROSCOPY
null
true
MSLVTELILSADSEARYPAPKELRIFQDFVKTGEQRVRIAKALAANEERIVQNGSQKFWERCPNTPSNSGVDRKTASCQRDQGWYVRLIAYSILAGSERPLEDIGTVGIKEMYNNLEIPIRNIAECMRCLKEEAMAVLSDEDAQEVAAYFDLIIQSLS
O
1.O
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.IA
true
false
588.2948
false
2
1
8uhe__1__1.M_1.N_1.R__1.GA
train
8uhe
ELECTRON MICROSCOPY
null
true
MSLVTELILSADSEARYPAPKELRIFQDFVKTGEQRVRIAKALAANEERIVQNGSQKFWERCPNTPSNSGVDRKTASCQRDQGWYVRLIAYSILAGSERPLEDIGTVGIKEMYNNLEIPIRNIAECMRCLKEEAMAVLSDEDAQEVAAYFDLIIQSLS
M
1.M
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.GA
true
false
588.2948
false
3
1
8uhe__1__1.M_1.N_1.R__1.GA
train
8uhe
ELECTRON MICROSCOPY
null
true
MQDAITTLINTSDAQGKYLDDSSLDTLQEYFRSGDLRAKAAMTISANASTIVTKTVAKSLLYTDITGPGGNMYTCRRYAACIRDMDFFLRYGTYAMLAGDASILDERVLNGLKETYNSLGVPVGATIRAVQAMKEVVNDMLGAEAGKEVGYYFDHICSGLS
N
1.N
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.GA
true
false
588.2948
false
3
1
8uhe__1__1.J_1.K__1.CA
train
8uhe
ELECTRON MICROSCOPY
null
true
MRDTVTSLISNYDTTGRYLDRDAIDSLQSYFITGANRVKVAAMISANAAEISREAGKKLFEVVPELIRPGGNAYTTRRYAACLRDMDYYLRYSSYALVAGNNDVLMERVLQGLRETYNSLGVPIAPTVQGIQIMKEMVKERASDMGVDDTSFIDQPFDFISREVSEISV
J
1.J
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.CA
true
false
588.2948
false
2
1
8uhe__1__1.J_1.K__1.CA
train
8uhe
ELECTRON MICROSCOPY
null
true
MTDRTNGGSPVVHPQQYHTVPTAVINGAHQRDRYPNHSEMQTLSTFLRTGLQRLEIAQTLAQHANEIVAAGGKRIFVGGNPMAYFEQPEELVGMPGSGYFVAEDYLSPKSRRQTGNGHSVQNSSSSITNPVAWLKGLFFSGKPSVPSRFQAINIADYGAVRMKRSMRDLGWFLRYITYAVVAGDTSIITVNTRGLRGIIPEDVTVATTVALQEMQWKSLSFFPVDSAAAALVRRYFDVLIADYQVEKPSDRYRTGVSKHDQGLSFPESYEDSGCAIPRWVMKPTLPDSEKDAVIRAAYRQVFERDISGLGTAELTQPISQ...
K
1.K
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.CA
true
false
588.2948
false
2
1
8uhi__1__1.K_1.L__1.U_1.V
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
K
1.K
O=C(COP(=O)(O)O)[C@H](O)[C@H](O)COP(=O)(O)O
RUB
1.U
true
false
309.985474
false
2
2
8uhi__1__1.K_1.L__1.U_1.V
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
K
1.K
[Mg+2]
MG
1.V
false
false
23.983944
false
2
2
8uhi__1__1.M_1.N__1.AA_1.BA
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
M
1.M
O=C(COP(=O)(O)O)[C@H](O)[C@H](O)COP(=O)(O)O
RUB
1.AA
true
false
309.985474
false
2
2
8uhi__1__1.M_1.N__1.AA_1.BA
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
M
1.M
[Mg+2]
MG
1.BA
false
false
23.983944
false
2
2
8uhi__1__1.I_1.J__1.S_1.T
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
I
1.I
O=C(COP(=O)(O)O)[C@H](O)[C@H](O)COP(=O)(O)O
RUB
1.S
true
false
309.985474
false
2
2
8uhi__1__1.I_1.J__1.S_1.T
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
I
1.I
[Mg+2]
MG
1.T
false
false
23.983944
false
2
2
8uhi__1__1.I_1.J__1.Q_1.R
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
I
1.I
O=C(COP(=O)(O)O)[C@H](O)[C@H](O)COP(=O)(O)O
RUB
1.Q
true
false
309.985474
false
2
2
8uhi__1__1.I_1.J__1.Q_1.R
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
I
1.I
[Mg+2]
MG
1.R
false
false
23.983944
false
2
2
8ui7__1__1.A_1.B__1.I_1.J
train
8ui7
ELECTRON MICROSCOPY
null
true
FDESSQDTSEKSQDCDVQCKAKRDFLMSGLPDLLKRQIAKKAAALDVYNAVSTSFQRVVHVQQKDDGCCLWHLKPPSCPLLTKFKELNTKVIDLSKCGIALGEFSTLNSKLKSGNSAAVFMRTRKEFTEEVRNLLLEEIRWSNPEFSLKKYFPLLLKKQIEHQVLSSECHSKQELEADVSHKETKRKLVEAENSKSKRKKPNEYSKNLEKTNRKSEELSKRNNSSGIKLDSSKDSGTEDMLWTEKYQPQTASELIGNELAIKKLHSWLKDWKRRAELEERQNLKGKRDEKHEDFSGGIDFKGSSDDEEESRLCNTVLITG...
A
1.A
[Mg+2]
MG
1.I
false
false
23.983944
false
2
2
8ui7__1__1.A_1.B__1.I_1.J
train
8ui7
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
[Mg+2]
MG
1.I
false
false
23.983944
false
2
2
8ui7__1__1.A_1.B__1.I_1.J
train
8ui7
ELECTRON MICROSCOPY
null
true
FDESSQDTSEKSQDCDVQCKAKRDFLMSGLPDLLKRQIAKKAAALDVYNAVSTSFQRVVHVQQKDDGCCLWHLKPPSCPLLTKFKELNTKVIDLSKCGIALGEFSTLNSKLKSGNSAAVFMRTRKEFTEEVRNLLLEEIRWSNPEFSLKKYFPLLLKKQIEHQVLSSECHSKQELEADVSHKETKRKLVEAENSKSKRKKPNEYSKNLEKTNRKSEELSKRNNSSGIKLDSSKDSGTEDMLWTEKYQPQTASELIGNELAIKKLHSWLKDWKRRAELEERQNLKGKRDEKHEDFSGGIDFKGSSDDEEESRLCNTVLITG...
A
1.A
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.J
true
false
522.9729
false
2
2
8ui7__1__1.A_1.B__1.I_1.J
train
8ui7
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.J
true
false
522.9729
false
2
2
8uhi__1__1.K_1.L__1.W_1.X
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
K
1.K
O=C(COP(=O)(O)O)[C@H](O)[C@H](O)COP(=O)(O)O
RUB
1.W
true
false
309.985474
false
2
2
8uhi__1__1.K_1.L__1.W_1.X
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
K
1.K
[Mg+2]
MG
1.X
false
false
23.983944
false
2
2
8uho__1__1.A_1.B__1.C
train
8uho
X-RAY DIFFRACTION
2.02
true
SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDVVYCPRHVICTSEDMLNPNYEDLLIRKSNHNFLVQAGNVQLRVIGHSMQNCVLKLKVDTANPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNFTIKGSFLNGSCGSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGNFYGPFVDRQTAQAAGTDTTITVNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQDHVDILGPLSAQTGIAVLDMCASLKELLQNGMNGRTILGSALLEDEFTPFDVVRQCSGVTFQ
A
1.A
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)OCc1ccccc1)C(=O)N[C@H](/C=C1/CCOC1=O)C[C@@H]1CCCO1
WTE
1.C
true
true
623.300659
true
2
1
8uhl__1__1.A__1.B
train
8uhl
X-RAY DIFFRACTION
1.92
true
GPLEDQEENTLRELRLFLRDVTKRLATDKRFNIFSKPVDIEEVSDYLEVIKEPMDLSTVITKIDKHNYLTAKDFLKDIDLICSNALEYNPDKDPGDKIIRHRACTLKDTAHAIIAAELDPEFNKLCEEIKEARIKR
A
1.A
CC(=O)NCCCC[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CN)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C=O)CCCN=C(N)N
GLY-GLY-LYS-GLY-LEU-GLY-ALY-GLY-GLY-ALA-LYS-ARG
1.B
true
false
1,110.662231
false
1
1
8uhi__1__1.M_1.N__1.Y_1.Z
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
M
1.M
O=C(COP(=O)(O)O)[C@H](O)[C@H](O)COP(=O)(O)O
RUB
1.Y
true
false
309.985474
false
2
2
8uhi__1__1.M_1.N__1.Y_1.Z
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
M
1.M
[Mg+2]
MG
1.Z
false
false
23.983944
false
2
2
8uhi__1__1.O_1.P__1.CA_1.DA
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
O
1.O
O=C(COP(=O)(O)O)[C@H](O)[C@H](O)COP(=O)(O)O
RUB
1.CA
true
false
309.985474
false
2
2
8uhi__1__1.O_1.P__1.CA_1.DA
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
O
1.O
[Mg+2]
MG
1.DA
false
false
23.983944
false
2
2
8uhe__1__1.P_1.Q__1.KA
train
8uhe
ELECTRON MICROSCOPY
null
true
MQDAITTLINTSDAQGKYLDDSSLDTLQEYFRSGDLRAKAAMTISANASTIVTKTVAKSLLYTDITGPGGNMYTCRRYAACIRDMDFFLRYGTYAMLAGDASILDERVLNGLKETYNSLGVPVGATIRAVQAMKEVVNDMLGAEAGKEVGYYFDHICSGLS
P
1.P
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.KA
true
false
588.2948
false
2
1
8uhe__1__1.P_1.Q__1.KA
train
8uhe
ELECTRON MICROSCOPY
null
true
MSLVTELILSADSEARYPAPKELRIFQDFVKTGEQRVRIAKALAANEERIVQNGSQKFWERCPNTPSNSGVDRKTASCQRDQGWYVRLIAYSILAGSERPLEDIGTVGIKEMYNNLEIPIRNIAECMRCLKEEAMAVLSDEDAQEVAAYFDLIIQSLS
Q
1.Q
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.KA
true
false
588.2948
false
2
1
8uho__1__1.A_1.B__1.D
train
8uho
X-RAY DIFFRACTION
2.02
true
SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDVVYCPRHVICTSEDMLNPNYEDLLIRKSNHNFLVQAGNVQLRVIGHSMQNCVLKLKVDTANPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNFTIKGSFLNGSCGSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGNFYGPFVDRQTAQAAGTDTTITVNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQDHVDILGPLSAQTGIAVLDMCASLKELLQNGMNGRTILGSALLEDEFTPFDVVRQCSGVTFQ
A
1.A
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)OCc1ccccc1)C(=O)N[C@H](/C=C1/CCOC1=O)C[C@@H]1CCCO1
WTE
1.D
true
false
623.300659
false
2
1
8ui1__1__1.A__1.B_1.C
train
8ui1
X-RAY DIFFRACTION
2.91
true
GARDVQEGVSSFEESGGAQLPPRVHALEVLEGAGPGRLHGRLGIKPDGQPGYTRAPSPPTDLSMPQALARGGGFNLYLSDHLELDRTAPDARHASCRQLHYDLSTLPKASVIIVFYNEPFSTLMRSVHSVLNGTPPQILEELILVDDGSTLPYIREDGNQQLVEYLKLLPAKVRLIRNEVRKGIVGARMKGIRASRAPIFAILDSHIEVSPQWLEPLLLRIKEDSRRVVMPQIDGIDAETFKHIAGGIGCKLGFLWKLMEHSYEGHQTARLPPEERQPSPTDFQTSPAMAGGLFAANKAFFFDVGAYDEDFQFWGTENLE...
A
1.A
O=c1ccn([C@@H]2O[C@H](CO[P@@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)[nH]1
UDP
1.B
true
false
404.002197
true
1
2
8ui1__1__1.A__1.B_1.C
train
8ui1
X-RAY DIFFRACTION
2.91
true
GARDVQEGVSSFEESGGAQLPPRVHALEVLEGAGPGRLHGRLGIKPDGQPGYTRAPSPPTDLSMPQALARGGGFNLYLSDHLELDRTAPDARHASCRQLHYDLSTLPKASVIIVFYNEPFSTLMRSVHSVLNGTPPQILEELILVDDGSTLPYIREDGNQQLVEYLKLLPAKVRLIRNEVRKGIVGARMKGIRASRAPIFAILDSHIEVSPQWLEPLLLRIKEDSRRVVMPQIDGIDAETFKHIAGGIGCKLGFLWKLMEHSYEGHQTARLPPEERQPSPTDFQTSPAMAGGLFAANKAFFFDVGAYDEDFQFWGTENLE...
A
1.A
[Mn+2]
MN
1.C
false
false
54.936947
true
1
2
8uhe__1__1.D_1.E__1.X
train
8uhe
ELECTRON MICROSCOPY
null
true
MQDAITTLINTSDAQGKYLDDSSLDTLQEYFRSGDLRAKAAMTISANASTIVTKTVAKSLLYTDITGPGGNMYTCRRYAACIRDMDFFLRYGTYAMLAGDASILDERVLNGLKETYNSLGVPVGATIRAVQAMKEVVNDMLGAEAGKEVGYYFDHICSGLS
D
1.D
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.X
true
true
588.2948
false
2
1
8uhe__1__1.D_1.E__1.X
train
8uhe
ELECTRON MICROSCOPY
null
true
MSLVTELILSADSEARYPAPKELRIFQDFVKTGEQRVRIAKALAANEERIVQNGSQKFWERCPNTPSNSGVDRKTASCQRDQGWYVRLIAYSILAGSERPLEDIGTVGIKEMYNNLEIPIRNIAECMRCLKEEAMAVLSDEDAQEVAAYFDLIIQSLS
E
1.E
CCC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)[C@H]4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O
CYC
1.X
true
true
588.2948
false
2
1
8ui8__1__1.A_1.B__1.H_1.I
train
8ui8
ELECTRON MICROSCOPY
null
true
FDESSQDTSEKSQDCDVQCKAKRDFLMSGLPDLLKRQIAKKAAALDVYNAVSTSFQRVVHVQQKDDGCCLWHLKPPSCPLLTKFKELNTKVIDLSKCGIALGEFSTLNSKLKSGNSAAVFMRTRKEFTEEVRNLLLEEIRWSNPEFSLKKYFPLLLKKQIEHQVLSSECHSKQELEADVSHKETKRKLVEAENSKSKRKKPNEYSKNLEKTNRKSEELSKRNNSSGIKLDSSKDSGTEDMLWTEKYQPQTASELIGNELAIKKLHSWLKDWKRRAELEERQNLKGKRDEKHEDFSGGIDFKGSSDDEEESRLCNTVLITG...
A
1.A
[Mg+2]
MG
1.H
false
false
23.983944
false
2
2
8ui8__1__1.A_1.B__1.H_1.I
train
8ui8
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
[Mg+2]
MG
1.H
false
false
23.983944
false
2
2
8ui8__1__1.A_1.B__1.H_1.I
train
8ui8
ELECTRON MICROSCOPY
null
true
FDESSQDTSEKSQDCDVQCKAKRDFLMSGLPDLLKRQIAKKAAALDVYNAVSTSFQRVVHVQQKDDGCCLWHLKPPSCPLLTKFKELNTKVIDLSKCGIALGEFSTLNSKLKSGNSAAVFMRTRKEFTEEVRNLLLEEIRWSNPEFSLKKYFPLLLKKQIEHQVLSSECHSKQELEADVSHKETKRKLVEAENSKSKRKKPNEYSKNLEKTNRKSEELSKRNNSSGIKLDSSKDSGTEDMLWTEKYQPQTASELIGNELAIKKLHSWLKDWKRRAELEERQNLKGKRDEKHEDFSGGIDFKGSSDDEEESRLCNTVLITG...
A
1.A
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.I
true
false
522.9729
false
2
2
8ui8__1__1.A_1.B__1.H_1.I
train
8ui8
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.I
true
false
522.9729
false
2
2
8ui7__1__1.C__1.M_1.N
train
8ui7
ELECTRON MICROSCOPY
null
true
METSALKQQEQPAATKIRNLPWVEKYRPQTLNDLISHQDILSTIQKFINEDRLPHLLLYGPPGTGKTSTILACAKQLYKDKEFGSMVLELNASDDRGIDIIRGPILSFASTRTIFKKGFKLVILDEADAMTQDAQNALRRVIEKFTENTRFCLICNYLSKIIPALQSRCTRFRFGPLTPELMVPRLEHVVEEEKVDISEDGMKALVTLSSGDMRRALNILQSTNMAFGKVTEETVYTCTGHPLKSDIANILDWMLNQDFTTAYRNITELKTLKGLALHDILTEIHLFVHRVDFPSSVRIHLLTKMADIEYRLSVGTNEKI...
C
1.C
[Mg+2]
MG
1.M
false
false
23.983944
false
1
2
8ui7__1__1.C__1.M_1.N
train
8ui7
ELECTRON MICROSCOPY
null
true
METSALKQQEQPAATKIRNLPWVEKYRPQTLNDLISHQDILSTIQKFINEDRLPHLLLYGPPGTGKTSTILACAKQLYKDKEFGSMVLELNASDDRGIDIIRGPILSFASTRTIFKKGFKLVILDEADAMTQDAQNALRRVIEKFTENTRFCLICNYLSKIIPALQSRCTRFRFGPLTPELMVPRLEHVVEEEKVDISEDGMKALVTLSSGDMRRALNILQSTNMAFGKVTEETVYTCTGHPLKSDIANILDWMLNQDFTTAYRNITELKTLKGLALHDILTEIHLFVHRVDFPSSVRIHLLTKMADIEYRLSVGTNEKI...
C
1.C
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.N
true
false
522.9729
false
1
2
8ui7__1__1.D__1.O
train
8ui7
ELECTRON MICROSCOPY
null
true
MQAFLKGTSISTKPPLTKDRGVAASAGSSGENKKAKPVPWVEKYRPKCVDEVAFQEEVVAVLKKSLEGADLPNLLFYGPPGTGKTSTILAAARELFGPELFRLRVLELNASDERGIQVVREKVKNFAQLTVSGSRSDGKPCPPFKIVILDEADSMTSAAQAALRRTMEKESKTTRFCLICNYVSRIIEPLTSRCSKFRFKPLSDKIQQQRLLDIAKKENVKISDEGIAYLVKVSEGDLRKAITFLQSATRLTGGKEITEKVITDIAGVIPAEKIDGVFAACQSGSFDKLEAVVKDLIDEGHAATQLVNQLHDVVVENNLS...
D
1.D
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
ADP
1.O
true
false
427.029419
false
1
1
8uhi__1__1.O_1.P__1.EA_1.FA
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
O
1.O
O=C(COP(=O)(O)O)[C@H](O)[C@H](O)COP(=O)(O)O
RUB
1.EA
true
false
309.985474
false
2
2
8uhi__1__1.O_1.P__1.EA_1.FA
train
8uhi
ELECTRON MICROSCOPY
null
true
MSYSQTQSKSGAGYDAGVQDYRLTYYAPDYTPRDTDILAAFRMTPQPGVPPEECAAAVAAESSTGTWTTVWTDLLTDMDRYRGRCYDIEPVPGEDNQYIAYVAYPLDLFEEGSVTNLLTSLVGNVFGFKALRALRLEDLRIPVAYVKTFQGPPHGIQVERDRINKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENINSQPFQRWRDRFLFVADAIHKSQAETGEIKGHYLNVTAATCEEMMKRAAYAKELEMPIVMHDFLTGGFTANTTLAHWCRDNGILLHIHRAMHAVIDRQKNHGIHFRVLAKCLR...
O
1.O
[Mg+2]
MG
1.FA
false
false
23.983944
false
2
2
8ui6__1__1.A_1.B__1.B_1.C_1.D_1.G
train
8ui6
X-RAY DIFFRACTION
2.65
true
GARDVQEGVSSFEESGGAQLPPRVHALEVLEGAGPGRLHGRLGIKPDGQPGYTRAPSPPTDLSMPQALARGGGFNLYLSDHLELDRTAPDARHASCRQLHYDLSTLPKASVIIVFYNEPFSTLMRSVHSVLNGTPPQILEELILVDDGSTLPYIREDGNQQLVEYLKLLPAKVRLIRNEVRKGIVGARMKGIRASRAPIFAILDSHIEVSPQWLEPLLLRIKEDSRRVVMPQIDGIDAETFKHIAGGIGCKLGFLWKLMEHSYEGHQTARLPPEERQPSPTDFQTSPAMAGGLFAANKAFFFDVGAYDEDFQFWGTENLE...
A
1.A
C[C@@H](O)[C@H](NC(=O)CN)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C=O)[C@@H](C)O
GLY-THR-THR-PRO-SER-PRO
1.B
true
false
542.27002
false
2
4
8ui6__1__1.A_1.B__1.B_1.C_1.D_1.G
train
8ui6
X-RAY DIFFRACTION
2.65
true
GARDVQEGVSSFEESGGAQLPPRVHALEVLEGAGPGRLHGRLGIKPDGQPGYTRAPSPPTDLSMPQALARGGGFNLYLSDHLELDRTAPDARHASCRQLHYDLSTLPKASVIIVFYNEPFSTLMRSVHSVLNGTPPQILEELILVDDGSTLPYIREDGNQQLVEYLKLLPAKVRLIRNEVRKGIVGARMKGIRASRAPIFAILDSHIEVSPQWLEPLLLRIKEDSRRVVMPQIDGIDAETFKHIAGGIGCKLGFLWKLMEHSYEGHQTARLPPEERQPSPTDFQTSPAMAGGLFAANKAFFFDVGAYDEDFQFWGTENLE...
A
1.A
[Mn+2]
MN
1.C
false
false
54.936947
false
2
4
8ui6__1__1.A_1.B__1.B_1.C_1.D_1.G
train
8ui6
X-RAY DIFFRACTION
2.65
true
GTTPSPVPTTSTTSAP
B
1.B
[Mn+2]
MN
1.C
false
false
54.936947
false
2
4
8ui6__1__1.A_1.B__1.B_1.C_1.D_1.G
train
8ui6
X-RAY DIFFRACTION
2.65
true
GARDVQEGVSSFEESGGAQLPPRVHALEVLEGAGPGRLHGRLGIKPDGQPGYTRAPSPPTDLSMPQALARGGGFNLYLSDHLELDRTAPDARHASCRQLHYDLSTLPKASVIIVFYNEPFSTLMRSVHSVLNGTPPQILEELILVDDGSTLPYIREDGNQQLVEYLKLLPAKVRLIRNEVRKGIVGARMKGIRASRAPIFAILDSHIEVSPQWLEPLLLRIKEDSRRVVMPQIDGIDAETFKHIAGGIGCKLGFLWKLMEHSYEGHQTARLPPEERQPSPTDFQTSPAMAGGLFAANKAFFFDVGAYDEDFQFWGTENLE...
A
1.A
O=c1ccn([C@@H]2O[C@H](CO[P@@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)[nH]1
UDP
1.D
true
false
404.002197
false
2
4
8ui6__1__1.A_1.B__1.B_1.C_1.D_1.G
train
8ui6
X-RAY DIFFRACTION
2.65
true
GTTPSPVPTTSTTSAP
B
1.B
O=c1ccn([C@@H]2O[C@H](CO[P@@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)[nH]1
UDP
1.D
true
false
404.002197
false
2
4
8ui6__1__1.A_1.B__1.B_1.C_1.D_1.G
train
8ui6
X-RAY DIFFRACTION
2.65
true
GARDVQEGVSSFEESGGAQLPPRVHALEVLEGAGPGRLHGRLGIKPDGQPGYTRAPSPPTDLSMPQALARGGGFNLYLSDHLELDRTAPDARHASCRQLHYDLSTLPKASVIIVFYNEPFSTLMRSVHSVLNGTPPQILEELILVDDGSTLPYIREDGNQQLVEYLKLLPAKVRLIRNEVRKGIVGARMKGIRASRAPIFAILDSHIEVSPQWLEPLLLRIKEDSRRVVMPQIDGIDAETFKHIAGGIGCKLGFLWKLMEHSYEGHQTARLPPEERQPSPTDFQTSPAMAGGLFAANKAFFFDVGAYDEDFQFWGTENLE...
A
1.A
CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1O
A2G
1.G
true
true
221.089935
false
2
4
8ui6__1__1.A_1.B__1.B_1.C_1.D_1.G
train
8ui6
X-RAY DIFFRACTION
2.65
true
GTTPSPVPTTSTTSAP
B
1.B
CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1O
A2G
1.G
true
true
221.089935
false
2
4
8ui7__1__1.A_1.E__1.P
train
8ui7
ELECTRON MICROSCOPY
null
true
FDESSQDTSEKSQDCDVQCKAKRDFLMSGLPDLLKRQIAKKAAALDVYNAVSTSFQRVVHVQQKDDGCCLWHLKPPSCPLLTKFKELNTKVIDLSKCGIALGEFSTLNSKLKSGNSAAVFMRTRKEFTEEVRNLLLEEIRWSNPEFSLKKYFPLLLKKQIEHQVLSSECHSKQELEADVSHKETKRKLVEAENSKSKRKKPNEYSKNLEKTNRKSEELSKRNNSSGIKLDSSKDSGTEDMLWTEKYQPQTASELIGNELAIKKLHSWLKDWKRRAELEERQNLKGKRDEKHEDFSGGIDFKGSSDDEEESRLCNTVLITG...
A
1.A
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
ADP
1.P
true
false
427.029419
false
2
1
8ui7__1__1.A_1.E__1.P
train
8ui7
ELECTRON MICROSCOPY
null
true
MSLWVDKYRPCSLGRLDYHKEQAAQLRNLVQCGDFPHLLVYGPSGAGKKTRIMCILRELYGVGVEKLRIEHQTITTPSKKKIEISTIASNYHLEVNPSDAGNSDRVVIQEMLKTVAQSQQLETNSQRDFKVVLLTEVDKLTKDAQHALRRTMEKYMSTCRLILCCNSTSKVIPPIRSRCLAVRVPAPSIEDICHVLSTVCKKEGLNLPSQLAHRLAEKSCRNLRKALLMCEACRVQQYPFTADQEIPETDWEVYLRETANAIVSQQTPQRLLEVRGRLYELLTHCIPPEIIMKGLLSELLHNCDGQLKGEVAQMAAYYEH...
E
1.E
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
ADP
1.P
true
false
427.029419
false
2
1
8ui8__1__1.A_1.E__1.O
train
8ui8
ELECTRON MICROSCOPY
null
true
FDESSQDTSEKSQDCDVQCKAKRDFLMSGLPDLLKRQIAKKAAALDVYNAVSTSFQRVVHVQQKDDGCCLWHLKPPSCPLLTKFKELNTKVIDLSKCGIALGEFSTLNSKLKSGNSAAVFMRTRKEFTEEVRNLLLEEIRWSNPEFSLKKYFPLLLKKQIEHQVLSSECHSKQELEADVSHKETKRKLVEAENSKSKRKKPNEYSKNLEKTNRKSEELSKRNNSSGIKLDSSKDSGTEDMLWTEKYQPQTASELIGNELAIKKLHSWLKDWKRRAELEERQNLKGKRDEKHEDFSGGIDFKGSSDDEEESRLCNTVLITG...
A
1.A
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
ADP
1.O
true
false
427.029419
false
2
1
8ui8__1__1.A_1.E__1.O
train
8ui8
ELECTRON MICROSCOPY
null
true
MSLWVDKYRPCSLGRLDYHKEQAAQLRNLVQCGDFPHLLVYGPSGAGKKTRIMCILRELYGVGVEKLRIEHQTITTPSKKKIEISTIASNYHLEVNPSDAGNSDRVVIQEMLKTVAQSQQLETNSQRDFKVVLLTEVDKLTKDAQHALRRTMEKYMSTCRLILCCNSTSKVIPPIRSRCLAVRVPAPSIEDICHVLSTVCKKEGLNLPSQLAHRLAEKSCRNLRKALLMCEACRVQQYPFTADQEIPETDWEVYLRETANAIVSQQTPQRLLEVRGRLYELLTHCIPPEIIMKGLLSELLHNCDGQLKGEVAQMAAYYEH...
E
1.E
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
ADP
1.O
true
false
427.029419
false
2
1
8ui8__1__1.B_1.C__1.J_1.K
train
8ui8
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
[Mg+2]
MG
1.J
false
false
23.983944
false
2
2
8ui8__1__1.B_1.C__1.J_1.K
train
8ui8
ELECTRON MICROSCOPY
null
true
METSALKQQEQPAATKIRNLPWVEKYRPQTLNDLISHQDILSTIQKFINEDRLPHLLLYGPPGTGKTSTILACAKQLYKDKEFGSMVLELNASDDRGIDIIRGPILSFASTRTIFKKGFKLVILDEADAMTQDAQNALRRVIEKFTENTRFCLICNYLSKIIPALQSRCTRFRFGPLTPELMVPRLEHVVEEEKVDISEDGMKALVTLSSGDMRRALNILQSTNMAFGKVTEETVYTCTGHPLKSDIANILDWMLNQDFTTAYRNITELKTLKGLALHDILTEIHLFVHRVDFPSSVRIHLLTKMADIEYRLSVGTNEKI...
C
1.C
[Mg+2]
MG
1.J
false
false
23.983944
false
2
2
8ui8__1__1.B_1.C__1.J_1.K
train
8ui8
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.K
true
false
522.9729
false
2
2
8ui8__1__1.B_1.C__1.J_1.K
train
8ui8
ELECTRON MICROSCOPY
null
true
METSALKQQEQPAATKIRNLPWVEKYRPQTLNDLISHQDILSTIQKFINEDRLPHLLLYGPPGTGKTSTILACAKQLYKDKEFGSMVLELNASDDRGIDIIRGPILSFASTRTIFKKGFKLVILDEADAMTQDAQNALRRVIEKFTENTRFCLICNYLSKIIPALQSRCTRFRFGPLTPELMVPRLEHVVEEEKVDISEDGMKALVTLSSGDMRRALNILQSTNMAFGKVTEETVYTCTGHPLKSDIANILDWMLNQDFTTAYRNITELKTLKGLALHDILTEIHLFVHRVDFPSSVRIHLLTKMADIEYRLSVGTNEKI...
C
1.C
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.K
true
false
522.9729
false
2
2
8ui8__1__1.C_1.D__1.L_1.M
train
8ui8
ELECTRON MICROSCOPY
null
true
METSALKQQEQPAATKIRNLPWVEKYRPQTLNDLISHQDILSTIQKFINEDRLPHLLLYGPPGTGKTSTILACAKQLYKDKEFGSMVLELNASDDRGIDIIRGPILSFASTRTIFKKGFKLVILDEADAMTQDAQNALRRVIEKFTENTRFCLICNYLSKIIPALQSRCTRFRFGPLTPELMVPRLEHVVEEEKVDISEDGMKALVTLSSGDMRRALNILQSTNMAFGKVTEETVYTCTGHPLKSDIANILDWMLNQDFTTAYRNITELKTLKGLALHDILTEIHLFVHRVDFPSSVRIHLLTKMADIEYRLSVGTNEKI...
C
1.C
[Mg+2]
MG
1.L
false
false
23.983944
false
2
2
8ui8__1__1.C_1.D__1.L_1.M
train
8ui8
ELECTRON MICROSCOPY
null
true
METSALKQQEQPAATKIRNLPWVEKYRPQTLNDLISHQDILSTIQKFINEDRLPHLLLYGPPGTGKTSTILACAKQLYKDKEFGSMVLELNASDDRGIDIIRGPILSFASTRTIFKKGFKLVILDEADAMTQDAQNALRRVIEKFTENTRFCLICNYLSKIIPALQSRCTRFRFGPLTPELMVPRLEHVVEEEKVDISEDGMKALVTLSSGDMRRALNILQSTNMAFGKVTEETVYTCTGHPLKSDIANILDWMLNQDFTTAYRNITELKTLKGLALHDILTEIHLFVHRVDFPSSVRIHLLTKMADIEYRLSVGTNEKI...
C
1.C
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.M
true
false
522.9729
false
2
2
8ui8__1__1.C_1.D__1.L_1.M
train
8ui8
ELECTRON MICROSCOPY
null
true
MQAFLKGTSISTKPPLTKDRGVAASAGSSGENKKAKPVPWVEKYRPKCVDEVAFQEEVVAVLKKSLEGADLPNLLFYGPPGTGKTSTILAAARELFGPELFRLRVLELNASDERGIQVVREKVKNFAQLTVSGSRSDGKPCPPFKIVILDEADSMTSAAQAALRRTMEKESKTTRFCLICNYVSRIIEPLTSRCSKFRFKPLSDKIQQQRLLDIAKKENVKISDEGIAYLVKVSEGDLRKAITFLQSATRLTGGKEITEKVITDIAGVIPAEKIDGVFAACQSGSFDKLEAVVKDLIDEGHAATQLVNQLHDVVVENNLS...
D
1.D
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.M
true
false
522.9729
false
2
2
8ui8__1__1.D__1.N
train
8ui8
ELECTRON MICROSCOPY
null
true
MQAFLKGTSISTKPPLTKDRGVAASAGSSGENKKAKPVPWVEKYRPKCVDEVAFQEEVVAVLKKSLEGADLPNLLFYGPPGTGKTSTILAAARELFGPELFRLRVLELNASDERGIQVVREKVKNFAQLTVSGSRSDGKPCPPFKIVILDEADSMTSAAQAALRRTMEKESKTTRFCLICNYVSRIIEPLTSRCSKFRFKPLSDKIQQQRLLDIAKKENVKISDEGIAYLVKVSEGDLRKAITFLQSATRLTGGKEITEKVITDIAGVIPAEKIDGVFAACQSGSFDKLEAVVKDLIDEGHAATQLVNQLHDVVVENNLS...
D
1.D
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
ADP
1.N
true
false
427.029419
false
1
1
8ui9__1__1.D__1.O_1.P
train
8ui9
ELECTRON MICROSCOPY
null
true
MQAFLKGTSISTKPPLTKDRGVAASAGSSGENKKAKPVPWVEKYRPKCVDEVAFQEEVVAVLKKSLEGADLPNLLFYGPPGTGKTSTILAAARELFGPELFRLRVLELNASDERGIQVVREKVKNFAQLTVSGSRSDGKPCPPFKIVILDEADSMTSAAQAALRRTMEKESKTTRFCLICNYVSRIIEPLTSRCSKFRFKPLSDKIQQQRLLDIAKKENVKISDEGIAYLVKVSEGDLRKAITFLQSATRLTGGKEITEKVITDIAGVIPAEKIDGVFAACQSGSFDKLEAVVKDLIDEGHAATQLVNQLHDVVVENNLS...
D
1.D
[Mg+2]
MG
1.O
false
false
23.983944
false
1
2
8ui9__1__1.D__1.O_1.P
train
8ui9
ELECTRON MICROSCOPY
null
true
MQAFLKGTSISTKPPLTKDRGVAASAGSSGENKKAKPVPWVEKYRPKCVDEVAFQEEVVAVLKKSLEGADLPNLLFYGPPGTGKTSTILAAARELFGPELFRLRVLELNASDERGIQVVREKVKNFAQLTVSGSRSDGKPCPPFKIVILDEADSMTSAAQAALRRTMEKESKTTRFCLICNYVSRIIEPLTSRCSKFRFKPLSDKIQQQRLLDIAKKENVKISDEGIAYLVKVSEGDLRKAITFLQSATRLTGGKEITEKVITDIAGVIPAEKIDGVFAACQSGSFDKLEAVVKDLIDEGHAATQLVNQLHDVVVENNLS...
D
1.D
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.P
true
false
522.9729
false
1
2
8uia__1__1.A_1.B__1.C
train
8uia
X-RAY DIFFRACTION
1.75
true
SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDVVYCPRHVICTSEDMLNPNYEDLLIRKSNHNFLVQAGNVQLRVIGHSMQNCVLKLKVDTANPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNFTIKGSFLNGSCGSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGNFYGPFVDRQTAQAAGTDTTITVNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQDHVDILGPLSAQTGIAVLDMCASLKELLQNGMNGRTILGSALLEDEFTPFDVVRQCSGVTFQ
A
1.A
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)OCc1ccccc1)C(=O)N[C@@H](C[C@H]1CCCO1)C[C@@H]1CCOC1=O
WTV
1.C
true
true
625.316345
false
2
1
8ui7__1__1.B_1.C__1.K_1.L
train
8ui7
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
[Mg+2]
MG
1.K
false
false
23.983944
false
2
2
8ui7__1__1.B_1.C__1.K_1.L
train
8ui7
ELECTRON MICROSCOPY
null
true
METSALKQQEQPAATKIRNLPWVEKYRPQTLNDLISHQDILSTIQKFINEDRLPHLLLYGPPGTGKTSTILACAKQLYKDKEFGSMVLELNASDDRGIDIIRGPILSFASTRTIFKKGFKLVILDEADAMTQDAQNALRRVIEKFTENTRFCLICNYLSKIIPALQSRCTRFRFGPLTPELMVPRLEHVVEEEKVDISEDGMKALVTLSSGDMRRALNILQSTNMAFGKVTEETVYTCTGHPLKSDIANILDWMLNQDFTTAYRNITELKTLKGLALHDILTEIHLFVHRVDFPSSVRIHLLTKMADIEYRLSVGTNEKI...
C
1.C
[Mg+2]
MG
1.K
false
false
23.983944
false
2
2
8ui7__1__1.B_1.C__1.K_1.L
train
8ui7
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.L
true
false
522.9729
false
2
2
8ui7__1__1.B_1.C__1.K_1.L
train
8ui7
ELECTRON MICROSCOPY
null
true
METSALKQQEQPAATKIRNLPWVEKYRPQTLNDLISHQDILSTIQKFINEDRLPHLLLYGPPGTGKTSTILACAKQLYKDKEFGSMVLELNASDDRGIDIIRGPILSFASTRTIFKKGFKLVILDEADAMTQDAQNALRRVIEKFTENTRFCLICNYLSKIIPALQSRCTRFRFGPLTPELMVPRLEHVVEEEKVDISEDGMKALVTLSSGDMRRALNILQSTNMAFGKVTEETVYTCTGHPLKSDIANILDWMLNQDFTTAYRNITELKTLKGLALHDILTEIHLFVHRVDFPSSVRIHLLTKMADIEYRLSVGTNEKI...
C
1.C
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.L
true
false
522.9729
false
2
2
8ui9__1__1.C_1.D__1.M_1.N
train
8ui9
ELECTRON MICROSCOPY
null
true
METSALKQQEQPAATKIRNLPWVEKYRPQTLNDLISHQDILSTIQKFINEDRLPHLLLYGPPGTGKTSTILACAKQLYKDKEFGSMVLELNASDDRGIDIIRGPILSFASTRTIFKKGFKLVILDEADAMTQDAQNALRRVIEKFTENTRFCLICNYLSKIIPALQSRCTRFRFGPLTPELMVPRLEHVVEEEKVDISEDGMKALVTLSSGDMRRALNILQSTNMAFGKVTEETVYTCTGHPLKSDIANILDWMLNQDFTTAYRNITELKTLKGLALHDILTEIHLFVHRVDFPSSVRIHLLTKMADIEYRLSVGTNEKI...
C
1.C
[Mg+2]
MG
1.M
false
false
23.983944
false
2
2
8ui9__1__1.C_1.D__1.M_1.N
train
8ui9
ELECTRON MICROSCOPY
null
true
METSALKQQEQPAATKIRNLPWVEKYRPQTLNDLISHQDILSTIQKFINEDRLPHLLLYGPPGTGKTSTILACAKQLYKDKEFGSMVLELNASDDRGIDIIRGPILSFASTRTIFKKGFKLVILDEADAMTQDAQNALRRVIEKFTENTRFCLICNYLSKIIPALQSRCTRFRFGPLTPELMVPRLEHVVEEEKVDISEDGMKALVTLSSGDMRRALNILQSTNMAFGKVTEETVYTCTGHPLKSDIANILDWMLNQDFTTAYRNITELKTLKGLALHDILTEIHLFVHRVDFPSSVRIHLLTKMADIEYRLSVGTNEKI...
C
1.C
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.N
true
false
522.9729
false
2
2
8ui9__1__1.C_1.D__1.M_1.N
train
8ui9
ELECTRON MICROSCOPY
null
true
MQAFLKGTSISTKPPLTKDRGVAASAGSSGENKKAKPVPWVEKYRPKCVDEVAFQEEVVAVLKKSLEGADLPNLLFYGPPGTGKTSTILAAARELFGPELFRLRVLELNASDERGIQVVREKVKNFAQLTVSGSRSDGKPCPPFKIVILDEADSMTSAAQAALRRTMEKESKTTRFCLICNYVSRIIEPLTSRCSKFRFKPLSDKIQQQRLLDIAKKENVKISDEGIAYLVKVSEGDLRKAITFLQSATRLTGGKEITEKVITDIAGVIPAEKIDGVFAACQSGSFDKLEAVVKDLIDEGHAATQLVNQLHDVVVENNLS...
D
1.D
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.N
true
false
522.9729
false
2
2
8uia__1__1.A_1.B__1.F
train
8uia
X-RAY DIFFRACTION
1.75
true
SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDVVYCPRHVICTSEDMLNPNYEDLLIRKSNHNFLVQAGNVQLRVIGHSMQNCVLKLKVDTANPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNFTIKGSFLNGSCGSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGNFYGPFVDRQTAQAAGTDTTITVNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQDHVDILGPLSAQTGIAVLDMCASLKELLQNGMNGRTILGSALLEDEFTPFDVVRQCSGVTFQ
A
1.A
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)OCc1ccccc1)C(=O)N[C@@H](C[C@H]1CCCO1)C[C@@H]1CCOC1=O
WTV
1.F
true
true
625.316345
false
2
1
8ui9__1__1.A_1.B__1.I_1.J
train
8ui9
ELECTRON MICROSCOPY
null
true
FDESSQDTSEKSQDCDVQCKAKRDFLMSGLPDLLKRQIAKKAAALDVYNAVSTSFQRVVHVQQKDDGCCLWHLKPPSCPLLTKFKELNTKVIDLSKCGIALGEFSTLNSKLKSGNSAAVFMRTRKEFTEEVRNLLLEEIRWSNPEFSLKKYFPLLLKKQIEHQVLSSECHSKQELEADVSHKETKRKLVEAENSKSKRKKPNEYSKNLEKTNRKSEELSKRNNSSGIKLDSSKDSGTEDMLWTEKYQPQTASELIGNELAIKKLHSWLKDWKRRAELEERQNLKGKRDEKHEDFSGGIDFKGSSDDEEESRLCNTVLITG...
A
1.A
[Mg+2]
MG
1.I
false
false
23.983944
false
2
2
8ui9__1__1.A_1.B__1.I_1.J
train
8ui9
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
[Mg+2]
MG
1.I
false
false
23.983944
false
2
2
8ui9__1__1.A_1.B__1.I_1.J
train
8ui9
ELECTRON MICROSCOPY
null
true
FDESSQDTSEKSQDCDVQCKAKRDFLMSGLPDLLKRQIAKKAAALDVYNAVSTSFQRVVHVQQKDDGCCLWHLKPPSCPLLTKFKELNTKVIDLSKCGIALGEFSTLNSKLKSGNSAAVFMRTRKEFTEEVRNLLLEEIRWSNPEFSLKKYFPLLLKKQIEHQVLSSECHSKQELEADVSHKETKRKLVEAENSKSKRKKPNEYSKNLEKTNRKSEELSKRNNSSGIKLDSSKDSGTEDMLWTEKYQPQTASELIGNELAIKKLHSWLKDWKRRAELEERQNLKGKRDEKHEDFSGGIDFKGSSDDEEESRLCNTVLITG...
A
1.A
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.J
true
false
522.9729
false
2
2
8ui9__1__1.A_1.B__1.I_1.J
train
8ui9
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.J
true
false
522.9729
false
2
2
8ui9__1__1.A_1.E__1.Q
train
8ui9
ELECTRON MICROSCOPY
null
true
FDESSQDTSEKSQDCDVQCKAKRDFLMSGLPDLLKRQIAKKAAALDVYNAVSTSFQRVVHVQQKDDGCCLWHLKPPSCPLLTKFKELNTKVIDLSKCGIALGEFSTLNSKLKSGNSAAVFMRTRKEFTEEVRNLLLEEIRWSNPEFSLKKYFPLLLKKQIEHQVLSSECHSKQELEADVSHKETKRKLVEAENSKSKRKKPNEYSKNLEKTNRKSEELSKRNNSSGIKLDSSKDSGTEDMLWTEKYQPQTASELIGNELAIKKLHSWLKDWKRRAELEERQNLKGKRDEKHEDFSGGIDFKGSSDDEEESRLCNTVLITG...
A
1.A
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
ADP
1.Q
true
false
427.029419
false
2
1
8ui9__1__1.A_1.E__1.Q
train
8ui9
ELECTRON MICROSCOPY
null
true
MSLWVDKYRPCSLGRLDYHKEQAAQLRNLVQCGDFPHLLVYGPSGAGKKTRIMCILRELYGVGVEKLRIEHQTITTPSKKKIEISTIASNYHLEVNPSDAGNSDRVVIQEMLKTVAQSQQLETNSQRDFKVVLLTEVDKLTKDAQHALRRTMEKYMSTCRLILCCNSTSKVIPPIRSRCLAVRVPAPSIEDICHVLSTVCKKEGLNLPSQLAHRLAEKSCRNLRKALLMCEACRVQQYPFTADQEIPETDWEVYLRETANAIVSQQTPQRLLEVRGRLYELLTHCIPPEIIMKGLLSELLHNCDGQLKGEVAQMAAYYEH...
E
1.E
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
ADP
1.Q
true
false
427.029419
false
2
1
8uii__1__1.A_1.B__1.I_1.J
train
8uii
ELECTRON MICROSCOPY
null
true
MVGVLAMAAAAAPPPVKDCEIEPCKKRKKDDDTSTCKTITKYLSPLGKTRDRVFAPPKPSNILDYFRKTSPTNEKTQLGKECKIKSPESVPVDSNKDCTTPLEMFSNVEFKKKRKRVNLSHQLNNIKTENEAPIEISSDDSKEDYSLNNDFVESSTSVLRYKKQVEVLAENIQDTKSQPNTMTSLQNSKKVNPKQGTTKNDFKKLRKRKCRDVVDLSESLPLAEELNLLKKDGKDTKQMENTTSHANSRDNVTEAAQLNDSIITVSYEEFLKSHKENKVEEIPDSTMSICVPSETVDEIVKSGYISESENSEISQQVRFK...
A
1.A
[Mg+2]
MG
1.I
false
false
23.983944
false
2
2
8uii__1__1.A_1.B__1.I_1.J
train
8uii
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
[Mg+2]
MG
1.I
false
false
23.983944
false
2
2
8uii__1__1.A_1.B__1.I_1.J
train
8uii
ELECTRON MICROSCOPY
null
true
MVGVLAMAAAAAPPPVKDCEIEPCKKRKKDDDTSTCKTITKYLSPLGKTRDRVFAPPKPSNILDYFRKTSPTNEKTQLGKECKIKSPESVPVDSNKDCTTPLEMFSNVEFKKKRKRVNLSHQLNNIKTENEAPIEISSDDSKEDYSLNNDFVESSTSVLRYKKQVEVLAENIQDTKSQPNTMTSLQNSKKVNPKQGTTKNDFKKLRKRKCRDVVDLSESLPLAEELNLLKKDGKDTKQMENTTSHANSRDNVTEAAQLNDSIITVSYEEFLKSHKENKVEEIPDSTMSICVPSETVDEIVKSGYISESENSEISQQVRFK...
A
1.A
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.J
true
false
522.9729
false
2
2
8uii__1__1.A_1.B__1.I_1.J
train
8uii
ELECTRON MICROSCOPY
null
true
MEVEAVCGGAGEVEAQDSDPAPAFSKAPGSAGHYELPWVEKYRPVKLNEIVGNEDTVSRLEVFAREGNVPNIIIAGPPGTGKTTSILCLARALLGPALKDAMLELNASNDRGIDVVRNKIKMFAQQKVTLPKGRHKIIILDEADSMTDGAQQALRRTMEIYSKTTRFALACNASDKIIEPIQSRCAVLRYTKLTDAQILTRLMNVIEKERVPYTDDGLEAIIFTAQGDMRQALNNLQSTFSGFGFINSENVFKVCDEPHPLLVKEMIQHCVNANIDEAYKILAHLWHLGYSPEDIIGNIFRVCKTFQMAEYLKLEFIKEI...
B
1.B
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(O)(O)=S)[C@@H](O)[C@H]1O
AGS
1.J
true
false
522.9729
false
2
2