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 Q05JF3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5KN0	Download	Experimental	e5kn0A3 e5kn0A2 e5kn0A3 e5kn0B3 e5kn0C1 e5kn0C2 e5kn0D1 e5kn0D2	Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like	LigPlot
5KN1	Download	Experimental	e5kn1A1 e5kn1B3	Thioredoxin-like Thioredoxin-like	LigPlot
5KN3	Download	Experimental	e5kn3A1	Thioredoxin-like	LigPlot