- 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 5 families. | |||||
1 | 5BRD | Ki = 32 uM | BG8 | C13 H17 N O6 | c1ccc(cc1).... |
2 | 5BRE | Ki = 0.71 uM | 4UZ | C14 H19 N O7 | c1ccc(cc1).... |
3 | 5BRH | Ki = 4.1 uM | 4V3 | C16 H19 N O9 S | c1ccc2c(c1.... |
4 | 2Q2R | - | BGC | C6 H12 O6 | C([C@@H]1[.... |
5 | 5BRF | Ki = 1.3 uM | 4V5 | C15 H21 N O7 | c1cc(ccc1C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 4 families. | |||||
1 | 5BRD | Ki = 32 uM | BG8 | C13 H17 N O6 | c1ccc(cc1).... |
2 | 5BRE | Ki = 0.71 uM | 4UZ | C14 H19 N O7 | c1ccc(cc1).... |
3 | 5BRH | Ki = 4.1 uM | 4V3 | C16 H19 N O9 S | c1ccc2c(c1.... |
4 | 2Q2R | - | BGC | C6 H12 O6 | C([C@@H]1[.... |
5 | 5BRF | Ki = 1.3 uM | 4V5 | C15 H21 N O7 | c1cc(ccc1C.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 4V5 | 1 | 1 |
2 | BGN | 0.583333 | 0.857143 |
3 | BM3 | 0.517241 | 0.829787 |
4 | NDG | 0.517241 | 0.829787 |
5 | NAG | 0.517241 | 0.829787 |
6 | HSQ | 0.517241 | 0.829787 |
7 | NGA | 0.517241 | 0.829787 |
8 | A2G | 0.517241 | 0.829787 |
9 | 4UZ | 0.507042 | 0.82 |
10 | BG8 | 0.463768 | 0.913043 |
11 | SIZ | 0.453125 | 0.795918 |
12 | 9C1 | 0.426471 | 0.78 |
This union binding pocket(no: 1) in the query (biounit: 5bre.bio1) has 34 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5bre.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |