Ligand name: beta-phenyl-D-phenylalanyl-N-propyl-L-prolinamide
PDB ligand accession: 44U
DrugBank: DB07083
PubChem: 25271577
ChEMBL: CHEMBL490730
InChI Key: HZKKJPDVZGOOPU-PZJWPPBQSA-N
SMILES: CCCNC(=O)C1CCCN1C(=O)C(C(c2ccccc2)c3ccccc3)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

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P00734

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3DA9	Download	Experimental	e3da9.1	cradle loop barrel	LigPlot