Ligand name: N-(BUTYLSULFONYL)-D-SERYL-N-{4-[AMINO(IMINO)METHYL]BENZYL}-L-ALANINAMIDE
PDB ligand accession: SI1
DrugBank: n/a
PubChem: 10113335
ChEMBL: n/a
InChI Key: GDNHYCQJIXDFDC-SWLSCSKDSA-N
SMILES: [H]N=C(c1ccc(cc1)CNC(=O)C(C)NC(=O)C(CO)NS(=O)(=O)CCCC)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 P00749

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1W0Z	Download	Experimental	e1w0zU1	cradle loop barrel	LigPlot