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 Q9KPB6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3QMN	Download	Experimental	e3qmnA1 e3qmnB1 e3qmnC1 e3qmnE1 e3qmnG1 e3qmnH1 e3qmnI1 e3qmnM1 e3qmnO1 e3qmnP1 e3qmnQ1 e3qmnR1 e3qmnS1 e3qmnU1 e3qmnV1 e3qmnW1	Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like	LigPlot