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 B7MLA1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5U3C	Download	Experimental	e5u3cA2 e5u3cC2 e5u3cB1 e5u3cD1 e5u3cA2 e5u3cC1 e5u3cC2	P-loop domains-like P-loop domains-like P-loop domains-like P-loop domains-like P-loop domains-like Flavodoxin-like P-loop domains-like	LigPlot
5U6R	Download	Experimental	e5u6rA2 e5u6rC2 e5u6rB1 e5u6rD1 e5u6rA2 e5u6rC1 e5u6rC2	P-loop domains-like P-loop domains-like P-loop domains-like P-loop domains-like P-loop domains-like Flavodoxin-like P-loop domains-like	LigPlot
8FV8	Download	Experimental	e8fv8AAA1 e8fv8AAA2 e8fv8BBB1 e8fv8AAA2 e8fv8BBB1 e8fv8BBB2	Flavodoxin-like P-loop domains-like P-loop domains-like P-loop domains-like P-loop domains-like Flavodoxin-like	LigPlot