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 D6QLY0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6RD3	Download	Experimental	e6rd3A1 e6rd3B1 e6rd3C1 e6rd3D1 e6rd3E1 e6rd3E1 e6rd3F1	Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels	LigPlot
5O79	Download	Experimental	e5o79A1 e5o79C1 e5o79B1 e5o79C1	Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels	LigPlot
5NUP	Download	Experimental	e5nupA1 e5nupD1 e5nupB1 e5nupB1 e5nupC1 e5nupF1 e5nupC1 e5nupE1 e5nupC1 e5nupF1	Outer membrane meander beta-barrels Phospholipid translocation channel MlaA Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels Phospholipid translocation channel MlaA Outer membrane meander beta-barrels Phospholipid translocation channel MlaA Outer membrane meander beta-barrels Phospholipid translocation channel MlaA	LigPlot
7Q3T	Download	Experimental	e7q3tA1 e7q3tB1 e7q3tC1 e7q3tE1 e7q3tD1 e7q3tE1 e7q3tF1	Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels	LigPlot