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 Q5NIQ1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4EEI	Download	Experimental	e4eeiA6 e4eeiB6 e4eeiB4	L-aspartase middle domain-like L-aspartase middle domain-like L-aspartase C-terminal domain-like	LigPlot
5HW2	Download	Experimental	e5hw2A1 e5hw2A3 e5hw2C2 e5hw2D2 e5hw2D3	L-aspartase middle domain-like L-aspartase N-terminal domain-like L-aspartase C-terminal domain-like L-aspartase middle domain-like L-aspartase N-terminal domain-like	LigPlot