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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 3 families. | |||||
1 | 3OBK | - | PBG | C10 H14 N2 O4 | c1c(c(c([n.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1W31 | Ki = 0.25 mM | SHO | C5 H10 O3 | C(CCO)CC(=.... |
2 | 5MHB | - | PBG | C10 H14 N2 O4 | c1c(c(c([n.... |
3 | 3OBK | - | PBG | C10 H14 N2 O4 | c1c(c(c([n.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | PBG | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | FER | 0.9261 |
2 | GJK | 0.9132 |
3 | CIY | 0.9054 |
4 | MPP | 0.9029 |
5 | N7I | 0.8958 |
6 | AC2 | 0.8924 |
7 | GT1 | 0.8854 |
8 | 8HH | 0.8836 |
9 | C9M | 0.8823 |
10 | U5A | 0.8811 |
11 | F6P | 0.8790 |
12 | 64F | 0.8740 |
13 | QR2 | 0.8713 |
14 | HKK | 0.8710 |
15 | PXP | 0.8688 |
16 | 78P | 0.8680 |
17 | H7Y | 0.8674 |
18 | 64E | 0.8673 |
19 | 34L | 0.8656 |
20 | 28S | 0.8652 |
21 | PLP | 0.8641 |
22 | TA6 | 0.8618 |
23 | IOP | 0.8618 |
24 | CKU | 0.8612 |
25 | 2UD | 0.8602 |
26 | HPT | 0.8583 |
27 | AEH | 0.8577 |
28 | JAA | 0.8572 |
29 | ML1 | 0.8567 |
30 | HFT | 0.8563 |
31 | G6P | 0.8562 |
32 | ASE | 0.8552 |
33 | ALA LYS | 0.8550 |
34 | M6P | 0.8544 |
35 | FUZ | 0.8542 |
36 | O2Y | 0.8519 |
37 | HWH | 0.8516 |
This union binding pocket(no: 1) in the query (biounit: 3obk.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 3obk.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 3obk.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 3obk.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 5) in the query (biounit: 3obk.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 6) in the query (biounit: 3obk.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 7) in the query (biounit: 3obk.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 8) in the query (biounit: 3obk.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |