- 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 1 families. | |||||
1 | 4WKE | ic50 = 8 nM | 3PU | C16 H11 Cl N4 O4 S | c1cc2c(cc1.... |
2 | 4WK7 | ic50 = 74 nM | 3PQ | C13 H14 Cl N3 O4 | C[C@]1(C(=.... |
3 | 4WKI | ic50 = 5 nM | 3PW | C17 H14 Cl N5 O4 | Cn1ccnc1[C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 4WKE | ic50 = 8 nM | 3PU | C16 H11 Cl N4 O4 S | c1cc2c(cc1.... |
2 | 4WK7 | ic50 = 74 nM | 3PQ | C13 H14 Cl N3 O4 | C[C@]1(C(=.... |
3 | 4WKI | ic50 = 5 nM | 3PW | C17 H14 Cl N5 O4 | Cn1ccnc1[C.... |
4 | 3HY9 | ic50 = 17 nM | 098 | C24 H29 N3 O5 | c1ccc2c(c1.... |
5 | 3HYG | ic50 = 93 nM | 099 | C20 H22 N2 O5 | c1ccc2c(c1.... |
6 | 3B8Z | ic50 = 0.29 uM | 294 | C19 H18 F3 N O6 S | c1cc(ccc1C.... |
7 | 3HY7 | ic50 = 106 nM | 097 | C15 H29 N3 O5 | CC(C)C[C@H.... |
8 | 3LJT | ic50 = 129 nM | LA3 | C27 H26 N2 O6 | c1ccc2c(c1.... |
9 | 3Q2H | ic50 = 0.69 nM | QHF | C23 H34 F N5 O5 S | Cc1c(c(on1.... |
10 | 2JIH | - | 097 | C15 H29 N3 O5 | CC(C)C[C@H.... |
11 | 3Q2G | ic50 = 3.5 nM | QGF | C23 H29 Cl2 F N4 O5 S | C[C@@H](C[.... |
This union binding pocket(no: 1) in the query (biounit: 4wki.bio1) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 2FV5 | 541 | 35.249 |
2 | 4DD8 | BAT | 43.75 |
3 | 4DD8 | BAT | 43.75 |
4 | 1KUK | PCA LYS TRP | 43.8424 |
5 | 1YP1 | LYS ASN LEU | 45.5446 |
6 | 1ATL | 0QI | 49.0099 |