Ligand name: 1,2-ETHANEDIOL
PDB ligand accession: EDO
DrugBank: n/a
PubChem: 174
ChEMBL: CHEMBL457299
InChI Key: LYCAIKOWRPUZTN-UHFFFAOYSA-N
SMILES: C(CO)O
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 Q7SIF4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8CFF	Download	Experimental	e8cffA1 e8cffB1 e8cffB2 e8cffC2 e8cffC3 e8cffC1 e8cffD1 e8cffD2 e8cffE1 e8cffE3 e8cffG3 e8cffH2	cradle loop barrel ISP domain Trm112p-like Rossmann-like Rossmann-like cradle loop barrel ISP domain Trm112p-like Rossmann-like Rossmann-like Formate dehydrogenase/DMSO reductase, domain 1 Trm112p-like	LigPlot
1G8K	Download	Experimental	e1g8kA3 e1g8kA2 e1g8kC2 e1g8kC4 e1g8kH1 e1g8kE2 e1g8kE3 e1g8kE1 e1g8kG2 e1g8kG4	Rossmann-like Formate dehydrogenase/DMSO reductase, domain 1 Rossmann-like Formate dehydrogenase/DMSO reductase, domain 1 ISP domain Rossmann-like Rossmann-like cradle loop barrel Rossmann-like Formate dehydrogenase/DMSO reductase, domain 1	LigPlot
8CGS	Download	Experimental	e8cgsE3	Rossmann-like	LigPlot