Ligand name: (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE
PDB ligand accession: C8E
DrugBank: DB04233
PubChem: 5414
ChEMBL: n/a
InChI Key: FEOZZFHAVXYAMB-UHFFFAOYSA-N
SMILES: CCCCCCCCOCCOCCOCCOCCO
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 A0A0W8AQT6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5NUR	Download	Experimental	e5nurA1 e5nurD1 e5nurA1 e5nurE1 e5nurB1	Outer membrane meander beta-barrels Phospholipid translocation channel MlaA Outer membrane meander beta-barrels Outer membrane meander beta-barrels Phospholipid translocation channel MlaA	LigPlot
5NUO	Download	Experimental	e5nuoC1 e5nuoF1 e5nuoD1 e5nuoA1 e5nuoB1 e5nuoE1 e5nuoF1	Outer membrane meander beta-barrels Phospholipid translocation channel MlaA Phospholipid translocation channel MlaA Outer membrane meander beta-barrels Phospholipid translocation channel MlaA Outer membrane meander beta-barrels Phospholipid translocation channel MlaA	LigPlot
5NUP	Download	Experimental	e5nupA1 e5nupD1 e5nupB1 e5nupC1 e5nupF1 e5nupD1 e5nupC1 e5nupE1 e5nupC1 e5nupF1	Outer membrane meander beta-barrels Phospholipid translocation channel MlaA Outer membrane meander beta-barrels Outer membrane meander beta-barrels Phospholipid translocation channel MlaA Phospholipid translocation channel MlaA Outer membrane meander beta-barrels Phospholipid translocation channel MlaA Outer membrane meander beta-barrels Phospholipid translocation channel MlaA	LigPlot