PDB ligand accession: ST6
DrugBank: DB02829
PubChem:
ChEMBL: n/a
InChI Key: FJGXEWVOOHZQDN-UHFFFAOYSA-O
SMILES: CC(=O)Nc1ccc(cc1NC(=O)C[NH3+])C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1INH | Download | Experimental | e1inhA1 e1inhB1 | beta-propeller-like beta-propeller-like | LigPlot |