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 Q9HTJ1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2WOX	Download	Experimental	e2woxA2 e2woxC1	ALDH-like ALDH-like	LigPlot
2WME	Download	Experimental	e2wmeA1 e2wmeA2 e2wmeB1 e2wmeB2 e2wmeD1 e2wmeD2 e2wmeF1 e2wmeF2 e2wmeG1 e2wmeG2	ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot