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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 1144 families. | |||||
1 | 3RT4 | Kd = 1.6 nM | LP5 | C34 H66 N O12 P | CCCCCCCCCC.... |
2 | 3NG4 | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
3 | 3NW3 | Kd = 0.32 uM | DGN ALA NDG LAC | n/a | n/a |
4 | 3O4K | Kd = 24 nM | LTC | C39 H70 N2 O13 | CCCCCCCC=C.... |
5 | 2CB3 | Kd = 27 nM | MLD | C37 H59 N7 O20 | C[C@@H](C(.... |
6 | 2APH | - | AMU ALA GMA LYS DAL DAL NH2 | n/a | n/a |
7 | 1TWQ | - | AMU ALA GMA LYS NH2 | n/a | n/a |
8 | 2EAX | Kd = 227 mM | ALA FGA LYS DAL DAL AMV NAG | n/a | n/a |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | ALA FGA LYS DAL DAL AMV NAG | 1 | 1 |
2 | AMV ALA FGA LYS DAL DAL | 0.762712 | 0.95 |
3 | AMU ALA NAG DGL | 0.622951 | 0.9 |
4 | MUB ALA NAG DGN | 0.612903 | 0.916667 |
5 | ALA FGA API DAL DAL MUB | 0.575758 | 0.9 |
6 | MUB ALA NAG GLN | 0.574803 | 0.9 |
7 | MUB ALA NAG ZGL | 0.554688 | 0.916667 |
8 | AMU ALA GMA LYS DAL DAL NH2 | 0.540741 | 0.933333 |
9 | AMV NAG AMU NAG | 0.533333 | 0.85 |
10 | AH0 ALA FGA LYS | 0.526718 | 0.890625 |
11 | NM9 NAG | 0.513043 | 0.85 |
12 | ALA NAG AH0 DAL | 0.507812 | 0.796875 |
13 | MLD | 0.506667 | 0.875 |
14 | NAG AH0 ALA DGL API DAL DAL | 0.503226 | 0.892308 |
15 | AMU ALA GMA LYS NH2 | 0.477941 | 0.933333 |
16 | MUB ALA ZGL ALY DAL NH2 | 0.471831 | 0.903226 |
17 | AMU NAG | 0.454545 | 0.833333 |
18 | DGN ALA NDG LAC | 0.4375 | 0.866667 |
19 | UAG API | 0.403409 | 0.721519 |
No: | Ligand | Similarity coefficient |
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