Ligand name: NICOTINAMIDE-ADENINE-DINUCLEOTIDE
PDB ligand accession: NAD
DrugBank: DB14128
PubChem: 5892;5288979;10897651;73415790;
ChEMBL: CHEMBL1234613
InChI Key: BAWFJGJZGIEFAR-NNYOXOHSSA-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)C(=O)N
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 Q5SI02

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2BJK	Download	Experimental	e2bjkA1 e2bjkA2 e2bjkB1 e2bjkB2	ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot
2EIT	Download	Experimental	e2eitA1 e2eitA2 e2eitB1 e2eitB2	ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot
2J40	Download	Experimental	e2j40A1 e2j40A2 e2j40B1 e2j40B2	ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot
2BJA	Download	Experimental	e2bjaA2 e2bjaB1 e2bjaB2	ALDH-like ALDH-like ALDH-like	LigPlot
2EHU	Download	Experimental	e2ehuA1 e2ehuA2 e2ehuB1 e2ehuB2	ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot
2BHP	Download	Experimental	e2bhpA1 e2bhpA2 e2bhpB1 e2bhpB2	ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot
2J5N	Download	Experimental	e2j5nA1 e2j5nA2 e2j5nB1 e2j5nB2	ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot
2EII	Download	Experimental	e2eiiA1 e2eiiA2 e2eiiB1 e2eiiB2	ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot