Ligand name: BETA-MERCAPTOETHANOL
PDB ligand accession: BME
DrugBank: DB03345
PubChem: 1567
ChEMBL: CHEMBL254951
InChI Key: DGVVWUTYPXICAM-UHFFFAOYSA-N
SMILES: C(CS)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organosulfur compounds
    • Class: Thiols
      • Subclass: Alkylthiols

List of PDB structures and/or AlphaFold models with target protein B4EL89

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2Y4O	Download	Experimental	e2y4oB2 e2y4oB3	Rossmann-like domain in Acetyl-CoA synthetase-like proteins beta-barrel domain in acetyl-CoA synthetase-like proteins	LigPlot