Ligand name: (2R,4aR,6R,7R,7aS)-6-(6-amino-8-bromo-9H-purin-9-yl)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol 2-sulfide
PDB ligand accession: RP2
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: RBORURQQJIQWBS-KVBUDSETSA-N
SMILES: c1nc(c2c(n1)n(c(n2)Br)C3C(C4C(O3)COP(=S)(O4)O)O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Nucleoside and nucleotide analogues
      • Subclass: 3',5'-cyclic purine nucleoside phosphorothioates

List of PDB structures and/or AlphaFold models with target protein P00514

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3PLQ	Download	Experimental	e3plqA1	jelly-roll	LigPlot