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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 13 families. | |||||
1 | 1O5E | Ki = 1.8 uM | 132 | C21 H17 Cl N3 O | c1ccc(cc1).... |
2 | 1P57 | Ki = 40 uM | CR4 | C14 H12 N4 O | c1ccc(c(c1.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 8 families. | |||||
1 | 1O5E | Ki = 1.8 uM | 132 | C21 H17 Cl N3 O | c1ccc(cc1).... |
2 | 1P57 | Ki = 40 uM | CR4 | C14 H12 N4 O | c1ccc(c(c1.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 696 | 0.9693 |
2 | 130 | 0.9659 |
3 | 780 | 0.9655 |
4 | 133 | 0.9460 |
5 | 134 | 0.9407 |
6 | 950 | 0.9391 |
7 | 972 | 0.9365 |
8 | CR3 | 0.9321 |
9 | 656 | 0.9276 |
10 | 655 | 0.9226 |
11 | CR9 | 0.9190 |
12 | 653 | 0.9179 |
13 | UQG | 0.9152 |
14 | DN6 | 0.9040 |
15 | 785 | 0.9016 |
16 | 41O | 0.9000 |
17 | 8JP | 0.8992 |
18 | 0J6 | 0.8911 |
19 | 3G9 | 0.8882 |
20 | J8Y | 0.8867 |
21 | LI3 | 0.8852 |
22 | 477 | 0.8830 |
23 | DN3 | 0.8790 |
24 | UQD | 0.8783 |
25 | 678 | 0.8697 |
26 | 6SQ | 0.8673 |
27 | DN8 | 0.8640 |
28 | PF2 | 0.8621 |
29 | QYD | 0.8598 |
30 | J2Q | 0.8584 |
31 | 520 | 0.8563 |
32 | 01I | 0.8549 |
This union binding pocket(no: 1) in the query (biounit: 1o5e.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 1NFU | RRP | 48.8189 |
2 | 1RTF | BEN | 50 |