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 A0A089XIW4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5VZ0	Download	Experimental	e5vz0A3 e5vz0A4 e5vz0B4 e5vz0B6 e5vz0D1 e5vz0D2	Protein kinase/SAICAR synthase/ATP-grasp alpha/beta-Hammerhead/Barrel-sandwich hybrid Protein kinase/SAICAR synthase/ATP-grasp alpha/beta-Hammerhead/Barrel-sandwich hybrid Protein kinase/SAICAR synthase/ATP-grasp alpha/beta-Hammerhead/Barrel-sandwich hybrid	LigPlot
5VYZ	Download	Experimental	e5vyzA4 e5vyzA8 e5vyzB1 e5vyzB4 e5vyzC1 e5vyzC2 e5vyzD4 e5vyzD8	alpha/beta-Hammerhead/Barrel-sandwich hybrid Protein kinase/SAICAR synthase/ATP-grasp alpha/beta-Hammerhead/Barrel-sandwich hybrid Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp alpha/beta-Hammerhead/Barrel-sandwich hybrid alpha/beta-Hammerhead/Barrel-sandwich hybrid Protein kinase/SAICAR synthase/ATP-grasp	LigPlot