Ligand name: 3-AMINOMETHYL-PYRIDINIUM-ADENINE-DINUCLEOTIDE
PDB ligand accession: NDA
DrugBank: DB03797
PubChem: 5288994;131704258;
ChEMBL: n/a
InChI Key: HMCRLFVYYFBZEZ-PLEFRAQWSA-N
SMILES: c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)O)O)O)O)CN
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: (5'->5')-dinucleotides
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P31116

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1EBU	Download	Experimental	e1ebuD1 e1ebuD2	FwdE/GAPDH domain-like Rossmann-like	LigPlot