Ligand name: HEXAETHYLENE GLYCOL
PDB ligand accession: P6G
DrugBank: n/a
PubChem: 17472
ChEMBL: CHEMBL1235082
InChI Key: IIRDTKBZINWQAW-UHFFFAOYSA-N
SMILES: C(COCCOCCOCCOCCOCCO)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Ethers

List of PDB structures and/or AlphaFold models with target protein Q9NPJ3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3F5O	Download	Experimental	e3f5oA1 e3f5oB1 e3f5oC1 e3f5oD1 e3f5oE1 e3f5oF1 e3f5oG1 e3f5oH1	Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like	LigPlot