Ligand name: (2S,3S,4R,5S)-2-({[(S)-{[(S)-{[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL]METHOXY}(HYDROXY)PHOSPHORYL]OXY}(HYDROXY)PHOSPHORYL]OXY}METHYL)-4,5-DIHYDROXYTETRAHYDROFURAN-3-YL ACETATE
PDB ligand accession: 3OD
DrugBank: n/a
PubChem: 9547961
ChEMBL: n/a
InChI Key: HNHCIVXQBMBKPQ-ARMUENPQSA-N
SMILES: CC(=O)OC1C(OC(C1O)O)COP(=O)(O)OP(=O)(O)OCC2C(C(C(O2)n3cnc4c3ncnc4N)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Purine nucleotides
      • Subclass: Purine nucleotide sugars

List of PDB structures and/or AlphaFold models with target protein Q9WYW0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2H59	Download	Experimental	e2h59B1 e2h59B2	Rubredoxin-like Rossmann-like	LigPlot