Ligand name: 5-[(2S)-4-methyl-2-{[(1H-pyrrol-3-ylacetyl)amino]methyl}pentyl]-1,3-benzodioxole-4-carboxylic acid
PDB ligand accession: H39
DrugBank: n/a
PubChem: 72551596
ChEMBL: n/a
InChI Key: NTYRVXHMFKAXSQ-HNNXBMFYSA-N
SMILES: CC(C)CC(Cc1ccc2c(c1C(=O)O)OCO2)CNC(=O)Cc3cc[nH]c3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzodioxoles
      • Subclass: None

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
4CJK	Download	Experimental	e4cjkA1 e4cjkB1	Ribonuclease H-like Ribonuclease H-like	LigPlot