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 P53779

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6EKD	Download	Experimental	e6ekdA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
2B1P	Download	Experimental	e2b1pA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
6EMH	Download	Experimental	e6emhA1 e6emhB1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
6EQ9	Download	Experimental	e6eq9A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
8BZP	Download	Experimental	e8bzpA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot