Ligand name: 2',3'-O-[(1r)-2,4,6-trinitrocyclohexa-2,5-diene-1,1-diyl]adenosine 5'-(dihydrogen phosphate)
PDB ligand accession: TM1
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: OHPXFACYTRBVRA-DLHKNTDHSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C4C(C(O3)COP(=O)(O)O)OC5(O4)C(=CC(C=C5[N+](=O)[O-])[N+](=O)[O-])[N+](=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 P04191

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3AR9	Download	Experimental	e3ar9A7 e3ar9A4	jelly-roll Metal cation-transporting ATPase, ATP-binding domain	LigPlot
3AR8	Download	Experimental	e3ar8A7 e3ar8A4 e3ar8A5	jelly-roll Metal cation-transporting ATPase, ATP-binding domain HAD domain-related	LigPlot
3AR5	Download	Experimental	e3ar5A4 e3ar5A5	Metal cation-transporting ATPase, ATP-binding domain HAD domain-related	LigPlot