Ligand name: BENZOIC ACID
PDB ligand accession: BEZ
DrugBank: DB03793
PubChem: 243;20144841;
ChEMBL: CHEMBL541
InChI Key: WPYMKLBDIGXBTP-UHFFFAOYSA-N
SMILES: c1ccc(cc1)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzoic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein Q4K4R5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4IJI	Download	Experimental	e4ijiF5 e4ijiF6 e4ijiH1 e4ijiH2	Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins	LigPlot