Ligand name: 1,4-BUTANEDIOL
PDB ligand accession: BU1
DrugBank: DB01955
PubChem: 8064
ChEMBL: CHEMBL171623
InChI Key: WERYXYBDKMZEQL-UHFFFAOYSA-N
SMILES: C(CCO)CO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Alcohols and polyols

List of PDB structures and/or AlphaFold models with target protein Q99VG8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3CED	Download	Experimental	e3cedA1 e3cedC1	Alpha-beta plaits Alpha-beta plaits	LigPlot