PDB ligand accession: AO5
DrugBank: DB07377
PubChem:
ChEMBL:
InChI Key: BYBVYIPUGPZRSX-OLZOCXBDSA-N
SMILES: CC(C)SCCC(C(C(=O)NNC(=O)c1cccc(c1)Cl)O)N
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1R58 | Download | Experimental | e1r58A1 e1r58A2 | HTH Creatinase/aminopeptidase-like | LigPlot |