PDB ligand accession: DI4
DrugBank: DB07659
PubChem:
ChEMBL: n/a
InChI Key: AILSWIBFGYYZTK-AABGKKOBSA-N
SMILES: B(C(CCCCCN)NC(=O)C1CCCN1C(=O)C(Cc2ccccc2)NC(=O)C)(O)O
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 |
---|---|---|---|---|---|
1LHF | Download | Experimental | e1lhf.1 | cradle loop barrel | LigPlot |