Ligand name: 2-methylbenzoic acid
PDB ligand accession: 3SK
DrugBank: n/a
PubChem: 8373
ChEMBL: CHEMBL114957
InChI Key: ZWLPBLYKEWSWPD-UHFFFAOYSA-N
SMILES: Cc1ccccc1C(=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 Q93TK0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4RLF	Download	Experimental	e4rlfA1 e4rlfA2 e4rlfB2 e4rlfB4	Rossmann-like domain in Acetyl-CoA synthetase-like proteins Alpha-lytic protease prodomain-like Rossmann-like domain in Acetyl-CoA synthetase-like proteins Alpha-lytic protease prodomain-like	LigPlot
4RLQ	Download	Experimental	e4rlqA4 e4rlqB2 e4rlqB4	Rossmann-like domain in Acetyl-CoA synthetase-like proteins Alpha-lytic protease prodomain-like Rossmann-like domain in Acetyl-CoA synthetase-like proteins	LigPlot