Ligand name: 4,4'-{propane-1,3-diylbis[oxy(5-methoxy-1-benzothiene-6,2-diyl)]}bis(4-oxobutanoic acid)
PDB ligand accession: QBA
DrugBank: n/a
PubChem: 139547010
ChEMBL: n/a
InChI Key: HFISEICXICVHGH-UHFFFAOYSA-N
SMILES: COc1cc2cc(sc2cc1OCCCOc3cc4c(cc3OC)cc(s4)C(=O)CCC(=O)O)C(=O)CCC(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzothiophenes
      • Subclass: 1-benzothiophenes

List of PDB structures and/or AlphaFold models with target protein Q12306

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6UKX	Download	Experimental	e6ukxA1 e6ukxB1	STING C-terminal domain STING C-terminal domain	LigPlot