Datasets:

PDBbind_test / 5zlf /5zlf_ligand.sdf
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Add batch 1
4a5f7c4 verified
5zlf_ligand
-I-interpret-
48 51 0 0 0 0 0 0 0 0999 V2000
64.8410 -4.4390 24.9730 C 0 0 0 0 0
66.0110 -5.1550 25.2740 C 0 0 0 0 0
66.3380 -5.4320 26.5930 C 0 0 0 0 0
65.5020 -5.0020 27.6160 C 0 0 0 0 0
64.3460 -4.2940 27.3180 C 0 0 0 0 0
64.0160 -4.0120 25.9820 C 0 0 0 0 0
62.9460 -3.3400 25.4020 O 0 0 0 0 0
63.1150 -3.3510 24.0230 C 0 0 0 0 0
64.2830 -4.0280 23.7590 C 0 0 0 0 0
64.7140 -4.1970 22.4370 C 0 0 0 0 0
63.9700 -3.6890 21.3860 C 0 0 0 0 0
62.7920 -3.0060 21.6510 C 0 0 0 0 0
62.3490 -2.8380 22.9540 C 0 0 0 0 0
61.1710 -2.1180 23.1140 C 0 0 0 0 0
60.9540 -1.0430 22.2650 C 0 0 0 0 0
60.2290 -2.4270 24.0820 C 0 0 0 0 0
59.0790 -1.6560 24.1870 C 0 0 0 0 0
58.8690 -0.5810 23.3330 C 0 0 0 0 0
59.8070 -0.2730 22.3580 C 0 0 0 0 0
59.6250 0.9080 21.3950 C 0 0 0 0 0
58.2770 0.9720 20.6650 C 0 0 0 0 0
58.3510 2.3500 19.4120 P 0 0 0 0 0
59.2920 1.9680 18.2940 O 0 0 0 0 0
58.8420 3.6190 20.0660 O 0 0 0 0 0
56.9720 2.5830 18.8400 O 0 0 0 0 0
57.8770 -0.5990 19.7440 P 0 0 0 0 0
58.9730 -0.8990 18.7500 O 0 0 0 0 0
57.7250 -1.7610 20.6960 O 0 0 0 0 0
56.5760 -0.4040 19.0000 O 0 0 0 0 0
57.2550 1.2590 21.5800 O 0 0 0 0 0
66.6635 -5.4937 24.4693 H 0 0 0 0 0
67.2478 -5.9852 26.8263 H 0 0 0 0 0
65.7542 -5.2209 28.6536 H 0 0 0 0 0
63.6927 -3.9560 28.1224 H 0 0 0 0 0
65.6417 -4.7322 22.2344 H 0 0 0 0 0
64.3071 -3.8246 20.3583 H 0 0 0 0 0
62.2085 -2.5971 20.8261 H 0 0 0 0 0
61.7011 -0.7995 21.5096 H 0 0 0 0 0
60.3895 -3.2687 24.7557 H 0 0 0 0 0
58.3347 -1.8965 24.9461 H 0 0 0 0 0
57.9659 0.0217 23.4289 H 0 0 0 0 0
60.3877 0.7973 20.6242 H 0 0 0 0 0
59.6906 1.8120 22.0004 H 0 0 0 0 0
58.9810 1.1611 17.8771 H 0 0 0 0 0
56.6589 1.7765 18.4239 H 0 0 0 0 0
57.0276 -1.5674 21.3267 H 0 0 0 0 0
55.8753 -0.2128 19.6277 H 0 0 0 0 0
56.4146 1.2977 21.1176 H 0 0 0 0 0
1 2 4 0 0 0
1 6 4 0 0 0
1 9 4 0 0 0
2 3 4 0 0 0
3 4 4 0 0 0
4 5 4 0 0 0
5 6 4 0 0 0
6 7 4 0 0 0
7 8 4 0 0 0
8 9 4 0 0 0
8 13 4 0 0 0
9 10 4 0 0 0
10 11 4 0 0 0
11 12 4 0 0 0
12 13 4 0 0 0
13 14 1 0 0 0
14 15 4 0 0 0
14 16 4 0 0 0
15 19 4 0 0 0
16 17 4 0 0 0
17 18 4 0 0 0
18 19 4 0 0 0
19 20 1 0 0 0
20 21 1 0 0 0
21 22 1 0 0 0
21 26 1 0 0 0
21 30 1 0 0 0
22 23 1 0 0 0
22 24 2 0 0 0
22 25 1 0 0 0
26 27 2 0 0 0
26 28 1 0 0 0
26 29 1 0 0 0
2 31 1 0 0 0
3 32 1 0 0 0
4 33 1 0 0 0
5 34 1 0 0 0
10 35 1 0 0 0
11 36 1 0 0 0
12 37 1 0 0 0
15 38 1 0 0 0
16 39 1 0 0 0
17 40 1 0 0 0
18 41 1 0 0 0
20 42 1 0 0 0
20 43 1 0 0 0
23 44 1 0 0 0
25 45 1 0 0 0
28 46 1 0 0 0
29 47 1 0 0 0
30 48 1 0 0 0
M END
$$$$