Ligand name: 4-(benzyloxy)-N-[(2S,3R)-3-hydroxy-1-{[(2S)-1-{[(3-methylthiophen-2-yl)methyl]amino}-1-oxo-4-phenylbutan-2-yl]amino}-1-oxobutan-2-yl]benzamide
PDB ligand accession: 3OE
DrugBank: n/a
PubChem: 52943040
ChEMBL: CHEMBL1269196
InChI Key: ARBUDFCHDYTBDG-AVKNQKEWSA-N
SMILES: Cc1ccsc1CNC(=O)C(CCc2ccccc2)NC(=O)C(C(C)O)NC(=O)c3ccc(cc3)OCc4ccccc4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein P30656

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3OEV	Download	Experimental	e3oevK1 e3oevL1 e3oevY1 e3oevZ1	Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C	LigPlot