Ligand name: demethylated cyclopeptin
PDB ligand accession: 58L
DrugBank: n/a
PubChem: 1502067
ChEMBL: CHEMBL233464
InChI Key: IOYQGXYNQRRATP-AWEZNQCLSA-N
SMILES: c1ccc(cc1)CC2C(=O)Nc3ccccc3C(=O)N2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzodiazepines
      • Subclass: 1,4-benzodiazepines

List of PDB structures and/or AlphaFold models with target protein Q5AR53

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5OA8	Download	Experimental	e5oa8A1	jelly-roll	LigPlot
5DAX	Download	Experimental	e5daxA1	jelly-roll	LigPlot