Ligand name: 2-chloranyl-6-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-benzoic acid
PDB ligand accession: 6QK
DrugBank: n/a
PubChem: 91781
ChEMBL: CHEMBL2251593
InChI Key: QEGVVEOAVNHRAA-UHFFFAOYSA-N
SMILES: COc1cc(nc(n1)Sc2cccc(c2C(=O)O)Cl)OC
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 P17597

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5K2O	Download	Experimental	e5k2oA1 e5k2oA2	Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like	LigPlot