- Navigate
- Expand All | Collapse All
- Receptor | Ligand | View in 3D
- Family: 90% | 70% | 50% | site
- External Links
- |
- Download
- 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 | 2V6K | - | TGG | C14 H21 N3 O10 S | C(CC(=O)N[.... |
2 | 2JL4 | - | GSH | C10 H17 N3 O6 S | C(CC(=O)N[.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1FW1 | - | GSH | C10 H17 N3 O6 S | C(CC(=O)N[.... |
2 | 2V6K | - | TGG | C14 H21 N3 O10 S | C(CC(=O)N[.... |
3 | 2JL4 | - | GSH | C10 H17 N3 O6 S | C(CC(=O)N[.... |
4 | 3N5O | - | GSH | C10 H17 N3 O6 S | C(CC(=O)N[.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | TGG | 1 | 1 |
2 | GS8 | 0.677419 | 0.765957 |
3 | GDS | 0.677419 | 0.883721 |
4 | GSM | 0.666667 | 0.837209 |
5 | AHE | 0.65625 | 0.857143 |
6 | HGD | 0.646154 | 0.840909 |
7 | GSH | 0.587302 | 0.9 |
8 | GTS | 0.575758 | 0.637931 |
9 | 0HH | 0.565789 | 0.787234 |
10 | P9H | 0.5625 | 0.904762 |
11 | GBP | 0.560976 | 0.606557 |
12 | BOB | 0.548781 | 0.791667 |
13 | GIP | 0.548781 | 0.606557 |
14 | GSB | 0.545455 | 0.837209 |
15 | GSF | 0.544118 | 0.698113 |
16 | GSO | 0.538462 | 0.818182 |
17 | GNB | 0.517241 | 0.633333 |
18 | GTB | 0.512195 | 0.637931 |
19 | GBI | 0.506024 | 0.75 |
20 | ESG | 0.5 | 0.684211 |
21 | GTD | 0.5 | 0.633333 |
22 | L9X | 0.5 | 0.684211 |
23 | 1R4 | 0.494118 | 0.627119 |
24 | GDN | 0.494118 | 0.612903 |
25 | GPR | 0.488372 | 0.72549 |
26 | GPS | 0.488372 | 0.72549 |
27 | 48T | 0.482759 | 0.765957 |
28 | BWS | 0.477612 | 0.829268 |
29 | GVX | 0.477273 | 0.804348 |
30 | LTX | 0.474747 | 0.791667 |
31 | HGS | 0.457143 | 0.880952 |
32 | HCG | 0.450704 | 0.878049 |
33 | LZ6 | 0.442105 | 0.698113 |
34 | TS4 | 0.435294 | 0.808511 |
35 | GTX | 0.432099 | 0.770833 |
36 | KSN | 0.430769 | 0.75 |
37 | 3GC | 0.421875 | 0.825 |
38 | 0HG | 0.411765 | 0.734694 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 2v6k.bio1) has 21 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 2v6k.bio1) has 21 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |