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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 1331 families. | |||||
1 | 6BKK | - | 308 | C10 H17 N | C1C2CC3CC1.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1144 families. | |||||
1 | 6BKK | - | 308 | C10 H17 N | C1C2CC3CC1.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 308 | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | ADM | 0.9669 |
2 | RIM | 0.9660 |
3 | EU7 | 0.9660 |
4 | CNL | 0.9565 |
5 | CAH | 0.9393 |
6 | ADO | 0.9365 |
7 | SVJ | 0.9207 |
8 | CAM | 0.9154 |
9 | 2BN | 0.9152 |
10 | CAE | 0.9118 |
11 | PTO | 0.9109 |
12 | BMA | 0.9052 |
13 | TMH | 0.9042 |
14 | TNE | 0.9019 |
15 | TLA | 0.8993 |
16 | NCM | 0.8975 |
17 | 4PW | 0.8940 |
18 | PAV | 0.8936 |
19 | OFQ | 0.8935 |
20 | FUL | 0.8923 |
21 | TCM | 0.8909 |
22 | BFM | 0.8896 |
23 | BDR | 0.8870 |
24 | RIP | 0.8849 |
25 | AHR | 0.8844 |
26 | FAC | 0.8838 |
27 | AI2 | 0.8830 |
28 | 3DY | 0.8827 |
29 | 34V | 0.8791 |
30 | XYP | 0.8790 |
31 | RUU | 0.8788 |
32 | XYS | 0.8773 |
33 | ASP | 0.8752 |
34 | 0MK | 0.8749 |
35 | GLC | 0.8744 |
36 | FRU | 0.8730 |
37 | DZX | 0.8730 |
38 | Z6J | 0.8724 |
39 | 3SY | 0.8719 |
40 | WTZ | 0.8718 |
41 | 4P0 | 0.8700 |
42 | IFL | 0.8686 |
43 | PBE | 0.8684 |
44 | FLC | 0.8680 |
45 | PAF | 0.8677 |
46 | DAS | 0.8653 |
47 | CGB | 0.8633 |
48 | DMJ | 0.8586 |
49 | CIT | 0.8520 |
This union binding pocket(no: 1) in the query (biounit: 6bkk.bio1) has 12 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 6bkk.bio2) has 11 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |