Ligand name: pentane-1,5-diol
PDB ligand accession: 9JE
DrugBank: n/a
PubChem: 8105
ChEMBL: CHEMBL448289
InChI Key: ALQSHHUCVQOPAS-UHFFFAOYSA-N
SMILES: C(CCO)CCO
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 B9A9M6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5O3M	Download	Experimental	e5o3mA2 e5o3mB1 e5o3mC1 e5o3mD2 e5o3mE2 e5o3mE3 e5o3mD1 e5o3mE3 e5o3mF2	Alpha-lytic protease prodomain-like Alpha-lytic protease prodomain-like cradle loop barrel Alpha-lytic protease prodomain-like N-terminal subdomain in UbiD middle domain Alpha-lytic protease prodomain-like N-terminal subdomain in UbiD middle domain Alpha-lytic protease prodomain-like Alpha-lytic protease prodomain-like	LigPlot