Ligand name: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2R,3R)-2,3,5-tris(oxidanyl)-4-oxidanylidene-pentyl] hydrogen phosphate
PDB ligand accession: 48F
DrugBank: n/a
PubChem: 118796330
ChEMBL: n/a
InChI Key: HMVGRTYSZXZGQZ-GHVQHMAVSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OCC(C(C(=O)CO)O)O)O)O)N
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q58018

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4Y4M	Download	Experimental	e4y4mA1 e4y4mD1 e4y4mF1 e4y4mB1 e4y4mB1 e4y4mC1 e4y4mD1 e4y4mE1 e4y4mE1 e4y4mG1 e4y4mF1 e4y4mH1 e4y4mA1 e4y4mG1 e4y4mC1 e4y4mH1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot