Ligand name: 5'-O-[(S)-hydroxy{[(R)-hydroxy({(S)-hydroxy[(1S)-1-(2-nitrophenyl)ethoxy]phosphoryl}oxy)phosphoryl]oxy}phosphoryl]adenosine
PDB ligand accession: A99
DrugBank: n/a
PubChem: 14188276
ChEMBL: n/a
InChI Key: UOLVQBSMMHANLG-YBGGAFRISA-N
SMILES: CC(c1ccccc1[N+](=O)[O-])OP(=O)(O)OP(=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 ribonucleotides

List of PDB structures and/or AlphaFold models with target protein Q97UU7

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2YJ5	Download	Experimental	e2yj5A5 e2yj5A6	Metal cation-transporting ATPase, ATP-binding domain HAD domain-related	LigPlot
2YJ6	Download	Experimental	e2yj6A5 e2yj6A6 e2yj6B5 e2yj6B6	Metal cation-transporting ATPase, ATP-binding domain HAD domain-related Metal cation-transporting ATPase, ATP-binding domain HAD domain-related	LigPlot