Ligand name: ADENOSINE DIPHOSPHATE 5-(BETA-ETHYL)-4-METHYL-THIAZOLE-2-CARBOXYLIC ACID
PDB ligand accession: AHZ
DrugBank: DB04362
PubChem: 5287651
ChEMBL: n/a
InChI Key: VGXBGQACJQRWLV-LKGUXBDMSA-K
SMILES: Cc1c(sc(n1)C(=O)[O-])CCOP(=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 Q9HGR2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3JSK	Download	Experimental	e3jskA1 e3jskF1 e3jskB1 e3jskH1 e3jskA1 e3jskC1 e3jskB1 e3jskD1 e3jskD1 e3jskE1 e3jskF1 e3jskG1 e3jskC1 e3jskG1 e3jskE1 e3jskH1 e3jskI1 e3jskN1 e3jskJ1 e3jskP1 e3jskI1 e3jskK1 e3jskJ1 e3jskL1 e3jskL1 e3jskM1 e3jskN1 e3jskO1 e3jskK1 e3jskO1 e3jskM1 e3jskP1	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 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