Ligand name: phenylmethanesulfonic acid
PDB ligand accession: PMS
DrugBank: DB03297
PubChem: 7532
ChEMBL: CHEMBL1171433
InChI Key: NIXKBAZVOQAHGC-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CS(=O)(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q45563

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2CBG	Download	Experimental	e2cbgA1	alpha/beta-Hydrolases	LigPlot