Ligand name: 5-[(2S)-2-{[(5-aminopentanoyl)amino]methyl}-4-methylpentyl]-1,3-benzodioxole-4-carboxylic acid
PDB ligand accession: 9PA
DrugBank: n/a
PubChem: 72551597
ChEMBL: n/a
InChI Key: PPUJEZUKUJTCNK-AWEZNQCLSA-N
SMILES: CC(C)CC(Cc1ccc2c(c1C(=O)O)OCO2)CNC(=O)CCCCN
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 Q76353

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4CJL	Download	Experimental	e4cjlA1	Ribonuclease H-like	LigPlot