Ligand name: 3-({[(1R)-1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)-5-[METHYL(METHYLSULFONYL)AMINO]BENZYL ALPHA-METHYL-D-PHENYLALANINATE
PDB ligand accession: 712
DrugBank: n/a
PubChem: 16094313
ChEMBL: CHEMBL218451
InChI Key: PTQRJCCBUDSHTQ-WHLCRQNOSA-N
SMILES: CC(c1ccc(cc1)F)NC(=O)c2cc(cc(c2)N(C)S(=O)(=O)C)COC(=O)C(C)(Cc3ccccc3)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzoic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein P56817

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2PH6	Download	Experimental	e2ph6A2 e2ph6A3	cradle loop barrel cradle loop barrel	LigPlot