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 W1QA59

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5LQX	Download	Experimental	e5lqxB1 e5lqxB2 e5lqxE2 e5lqxC1 e5lqxC3 e5lqxF2 e5lqxF3 e5lqxC3 e5lqxD1 e5lqxD3 e5lqxE1 e5lqxE2 e5lqxB2 e5lqxF2 e5lqxF3	C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase	LigPlot
5LQZ	Download	Experimental	e5lqzB2 e5lqzB3 e5lqzE1 e5lqzE3 e5lqzC2 e5lqzC3 e5lqzF1 e5lqzF2 e5lqzC2 e5lqzD2 e5lqzD3 e5lqzE1 e5lqzE3 e5lqzB3 e5lqzF1 e5lqzF2	C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like	LigPlot