Ligand name: 2(S)-{2(S)-[2(R)-AMINO-3-MERCAPTO]PROPYLAMINO-3(S)-METHYL}PENTYLOXY-3-PHENYLPROPIONYLMETHIONINE SULFONE
PDB ligand accession: 739
DrugBank: n/a
PubChem: 5287548
ChEMBL: n/a
InChI Key: SIEXHGZWGJLLAC-OSTWSGHESA-N
SMILES: CCC(C)C(COC(Cc1ccccc1)C(=O)NC(CCS(=O)(=O)C)C(=O)O)NCC(CS)N
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 P49354

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1JCQ	Download	Experimental	e1jcqB1 e1jcqA1	Repetitive alpha hairpins Repetitive alpha hairpins	LigPlot