Ligand name: (2R,5R,7R,8R,10R,12aR,14R,15aS,16R)-7-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-16-hydroxy-14-[(pyrimidin-4-yl)oxy]-2,10-disulfanyldecahydro-2H,10H-5,8-methano-2lambda~5~,10lambda~5~-cyclopenta[l][1,3,6,9,11,2,10]pentaoxadiphosphacyclotetradecine-2,10-dione
PDB ligand accession: X4M
DrugBank: n/a
PubChem: n/a
ChEMBL: CHEMBL5086820
InChI Key: OYKBZTYSLUEHAP-FEFYGENMSA-N
SMILES: c1cncnc1OC2CC3COP(=O)(OC4C(C(COP(=O)(OC3C2)S)OC4n5cnc6c5N=C(NC6=O)N)O)S
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Nucleoside and nucleotide analogues
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein A0A2R3XZB7

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7KW1	Download	Experimental	e7kw1A1	STING C-terminal domain	LigPlot