Ligand name: 4-(2-methylphenyl)-2,4-dioxobutanoic acid
PDB ligand accession: 040
DrugBank: n/a
PubChem: 510658
ChEMBL: CHEMBL185898
InChI Key: AVVYWVLNDGDANA-UHFFFAOYSA-N
SMILES: Cc1ccccc1C(=O)CC(=O)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbonyl compounds

List of PDB structures and/or AlphaFold models with target protein P0A5J4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3SAD	Download	Experimental	e3sadA1	TIM beta/alpha-barrel	LigPlot