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 B3LH69

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7TMS	Download	Experimental	e7tmsE2 e7tmsE4 e7tmsF2 e7tmsF3	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
7TMT	Download	Experimental	e7tmtE1 e7tmtE2 e7tmtF1 e7tmtF2	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	LigPlot
7TMR	Download	Experimental	e7tmrE1 e7tmrE2 e7tmrF2 e7tmrF3	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	LigPlot