Ligand name: 3,6,9,12,15,18,21-HEPTAOXATRICOSANE-1,23-DIOL
PDB ligand accession: PE8
DrugBank: n/a
PubChem: 78798
ChEMBL: n/a
InChI Key: GLZWNFNQMJAZGY-UHFFFAOYSA-N
SMILES: C(COCCOCCOCCOCCOCCOCCOCCO)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 Q9H2K2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3TWV	Download	Experimental	e3twvA1 e3twvB1 e3twvD1 e3twvC1	Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins	LigPlot
3TWR	Download	Experimental	e3twrC1 e3twrA1 e3twrB1 e3twrD1	Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins	LigPlot
3TWS	Download	Experimental	e3twsA1 e3twsB1 e3twsD1	Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins	LigPlot
3TWT	Download	Experimental	e3twtC1	Repetitive alpha hairpins	LigPlot