Ligand name: 3-(dimethyl-lambda~4~-sulfanyl)propanoic acid
PDB ligand accession: DQY
DrugBank: n/a
PubChem: 416901
ChEMBL: n/a
InChI Key: BBSYGEAKHYDEGI-UHFFFAOYSA-N
SMILES: CS(C)CCC(=O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q4FP21

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3TFI	Download	Experimental	e3tfiA2 e3tfiA3 e3tfiB3 e3tfiA3 e3tfiB2 e3tfiB3	Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits	LigPlot