Ligand name: 5-[(2S)-4-methyl-2-[(pyridin-4-ylcarbonylamino)methyl]pentyl]-1,3-benzodioxole-4-carboxylic acid
PDB ligand accession: S3G
DrugBank: n/a
PubChem: 72551592
ChEMBL: n/a
InChI Key: MNUFCQCGIBAEIV-AWEZNQCLSA-N
SMILES: CC(C)CC(Cc1ccc2c(c1C(=O)O)OCO2)CNC(=O)c3ccncc3
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
4CJ4	Download	Experimental	e4cj4A1 e4cj4B1	Ribonuclease H-like Ribonuclease H-like	LigPlot