Ligand name: (2S)-pentane-1,2-diol
PDB ligand accession: 1SP
DrugBank: n/a
PubChem: 6950523
ChEMBL: n/a
InChI Key: WCVRQHFDJLLWFE-YFKPBYRVSA-N
SMILES: CCCC(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 Q3J3W2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2WDZ	Download	Experimental	e2wdzA1 e2wdzD1 e2wdzB1 e2wdzD1 e2wdzC1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot