Ligand name: 3-[(carboxymethyl)sulfanyl]-2-oxopropanoic acid
PDB ligand accession: XYN
DrugBank: n/a
PubChem: 191201
ChEMBL: CHEMBL259106
InChI Key: FDUKYMHTXNDQPD-UHFFFAOYSA-N
SMILES: C(C(=O)C(=O)O)SCC(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Dicarboxylic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein Q8RQU4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3ASJ	Download	Experimental	e3asjA1 e3asjA2 e3asjB2	Isocitrate/Isopropylmalate dehydrogenase-like Isocitrate/Isopropylmalate dehydrogenase-like Isocitrate/Isopropylmalate dehydrogenase-like	LigPlot