Ligand name: N~2~-acetyl-N-[(2S,3R)-4-{(1,3-benzothiazol-6-ylsulfonyl)[(2S)-2-methylbutyl]amino}-3-hydroxy-1-phenylbutan-2-yl]-L-leucinamide
PDB ligand accession: 55A
DrugBank: n/a
PubChem: 56973520
ChEMBL: n/a
InChI Key: DTBCRFWBLISCCS-WNQFUHBBSA-N
SMILES: CCC(C)CN(CC(C(Cc1ccccc1)NC(=O)C(CC(C)C)NC(=O)C)O)S(=O)(=O)c2ccc3c(c2)scn3
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 O38732

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3SA7	Download	Experimental	e3sa7A1 e3sa7B1	cradle loop barrel cradle loop barrel	LigPlot