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 Q8IUQ4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4I7D	Download	Experimental	e4i7dA1 e4i7dC1	Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich	LigPlot
4I7C	Download	Experimental	e4i7cA1 e4i7cA2 e4i7cC1 e4i7cC2	Immunoglobulin-like beta-sandwich beta-beta-alpha zinc fingers Immunoglobulin-like beta-sandwich beta-beta-alpha zinc fingers	LigPlot