Ligand name: L-alanyl-N-[(1S,2R)-1-benzyl-2-hydroxypropyl]-L-alaninamide
PDB ligand accession: K7I
DrugBank: DB08038
PubChem: 46937118
ChEMBL: n/a
InChI Key: CPAOOGAUUDSJCS-FMSGJZPZSA-N
SMILES: CC(C(Cc1ccccc1)NC(=O)C(C)NC(=O)C(C)N)O
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 drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P49862

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2QXG	Download	Experimental	e2qxgA1 e2qxgB1	cradle loop barrel cradle loop barrel	LigPlot