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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 2O1S | - | TDP | C12 H18 N4 O7 P2 S | Cc1c(sc[n+.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 2O1S | - | TDP | C12 H18 N4 O7 P2 S | Cc1c(sc[n+.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | TDP | 1 | 1 |
2 | TPP | 0.84 | 0.985714 |
3 | V4E | 0.797468 | 0.985714 |
4 | TPS | 0.77027 | 0.942857 |
5 | TMV | 0.75 | 0.944444 |
6 | VNP | 0.703704 | 0.945205 |
7 | N1T | 0.674699 | 1 |
8 | 2TP | 0.609195 | 0.918919 |
9 | VIB | 0.605263 | 0.760563 |
10 | 5SR | 0.582418 | 0.958333 |
11 | FTP | 0.574713 | 0.847222 |
12 | O2T | 0.546392 | 0.896104 |
13 | PYI | 0.483871 | 0.873239 |
14 | TDW | 0.474227 | 0.958333 |
15 | HTL | 0.474227 | 0.945205 |
16 | AUJ | 0.47 | 0.907895 |
17 | THV | 0.46 | 0.945205 |
18 | TD6 | 0.457143 | 0.907895 |
19 | WWF | 0.455446 | 0.92 |
20 | TOG | 0.451923 | 0.907895 |
21 | TPW | 0.451613 | 0.885714 |
22 | THY | 0.45098 | 0.932432 |
23 | TD9 | 0.448598 | 0.907895 |
24 | TD8 | 0.448598 | 0.907895 |
25 | THW | 0.447619 | 0.945205 |
26 | TDL | 0.446602 | 0.884615 |
27 | TDK | 0.442308 | 0.907895 |
28 | D7K | 0.415929 | 0.896104 |
29 | TPU | 0.410526 | 0.828947 |
30 | S1T | 0.405941 | 0.873239 |
31 | R1T | 0.405941 | 0.873239 |
32 | T6F | 0.403509 | 0.884615 |
33 | T5X | 0.403509 | 0.884615 |
This union binding pocket(no: 1) in the query (biounit: 2o1s.bio1) has 19 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 3AI7 | TPP | 2.0934 |
This union binding pocket(no: 2) in the query (biounit: 2o1s.bio2) has 19 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |