Ligand name: (4S)-2-METHYL-2,4-PENTANEDIOL
PDB ligand accession: MPD
DrugBank: DB03564
PubChem: 5288834
ChEMBL: n/a
InChI Key: SVTBMSDMJJWYQN-YFKPBYRVSA-N
SMILES: CC(CC(C)(C)O)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 Q5FL96

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4IA5	Download	Experimental	e4ia5B1 e4ia5A1 e4ia5B1	Rossmann-like Rossmann-like Rossmann-like	LigPlot
4IA6	Download	Experimental	e4ia6A1 e4ia6B1 e4ia6B1 e4ia6B2	Rossmann-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like	LigPlot