PDB ligand accession: BQU
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: RXPAQUQGUPYCSG-UHFFFAOYSA-N
SMILES: c1ccc(cc1)OCc2nc(cs2)c3ccc(c(c3)CCC(=O)O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Phenylpropanoic acids
- Subclass: None
- Class: Phenylpropanoic acids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6JKA | Download | Experimental | e6jkaB1 e6jkaD1 | Metallo-hydrolase/oxidoreductase Metallo-hydrolase/oxidoreductase | LigPlot |