Ligand name: (2S,3S,4R,5R,2'S,3'S,4'R,5'R)-2,2'-[DITHIOBIS(METHYLENE)]BIS[5-(6-AMINO-9H-PURIN-9-YL)TETRAHYDROFURAN-3,4-DIOL]
PDB ligand accession: DTA
DrugBank: n/a
PubChem: 16741199
ChEMBL: CHEMBL561654
InChI Key: HYGRWPFOTXXMNB-XPWFQUROSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)CSSCC4C(C(C(O4)n5cnc6c5ncnc6N)O)O)O)O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: 5'-deoxyribonucleosides
      • Subclass: 5'-deoxy-5'-thionucleosides

List of PDB structures and/or AlphaFold models with target protein Q8Y8D7

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2I2C	Download	Experimental	e2i2cA1 e2i2cA2	NAD kinase beta sandwich domain-like Flavodoxin-like	LigPlot
2Q5F	Download	Experimental	e2q5fA1 e2q5fA2	NAD kinase beta sandwich domain-like Flavodoxin-like	LigPlot