Ligand name: 4-(2-bromoethyl)benzoic acid
PDB ligand accession: L3K
DrugBank: n/a
PubChem: 104068
ChEMBL: n/a
InChI Key: BKMRWJWLBHHGCF-UHFFFAOYSA-N
SMILES: c1cc(ccc1CCBr)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 Q2IU02

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7TZY	Download	Experimental	e7tzyA1	Cytochrome P450	LigPlot