Ligand name: ADENOSINE-5'-DIPHOSPHATE
PDB ligand accession: ADP
DrugBank: DB16833
PubChem: 6022
ChEMBL: CHEMBL14830
InChI Key: XTWYTFMLZFPYCI-KQYNXXCUSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(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 Q8U3I4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4R7Z	Download	Experimental	e4r7zH2 e4r7zA1 e4r7zA2 e4r7zB1 e4r7zA1 e4r7zA2 e4r7zB2 e4r7zC1 e4r7zD1 e4r7zC2 e4r7zE1 e4r7zD2 e4r7zF1 e4r7zE1 e4r7zE2 e4r7zF2 e4r7zG1 e4r7zH1 e4r7zG1 e4r7zG2 e4r7zP1 e4r7zP2 e4r7zI1 e4r7zJ1 e4r7zI2 e4r7zJ2 e4r7zK1 e4r7zK2 e4r7zL1 e4r7zM1 e4r7zL1 e4r7zL2 e4r7zM2 e4r7zN1 e4r7zN1 e4r7zN2 e4r7zO1 e4r7zP1 e4r7zO1 e4r7zO2	Histone-like P-loop domains-like Histone-like P-loop domains-like P-loop domains-like Histone-like Histone-like P-loop domains-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like P-loop domains-like Histone-like Histone-like P-loop domains-like P-loop domains-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like P-loop domains-like Histone-like Histone-like P-loop domains-like Histone-like P-loop domains-like P-loop domains-like P-loop domains-like Histone-like Histone-like P-loop domains-like P-loop domains-like Histone-like P-loop domains-like P-loop domains-like P-loop domains-like Histone-like	LigPlot