Ligand name: NICOTINATE MONONUCLEOTIDE
PDB ligand accession: NCN
DrugBank: DB02382
PubChem: 121991;5288991;
ChEMBL: n/a
InChI Key: JOUIQRNQJGXQDC-ZYUZMQFOSA-N
SMILES: c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)(O)[O-])O)O)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Pyridine nucleotides
      • Subclass: Nicotinic acid nucleotides

List of PDB structures and/or AlphaFold models with target protein I3LK75

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4I9A	Download	Experimental	e4i9aA2 e4i9aB2	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot