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 P25856

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3K2B	Download	Experimental	e3k2bA1 e3k2bA2 e3k2bD1 e3k2bB1 e3k2bB2 e3k2bC1 e3k2bB1 e3k2bC1 e3k2bC2 e3k2bA1 e3k2bA2 e3k2bD1 e3k2bD2 e3k2bE1 e3k2bE2 e3k2bH1 e3k2bF1 e3k2bF2 e3k2bG1 e3k2bG2 e3k2bF1 e3k2bG1 e3k2bG2 e3k2bE1 e3k2bE2 e3k2bH1 e3k2bH2 e3k2bO1 e3k2bO2 e3k2bQ1 e3k2bQ2	FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like	LigPlot
6KEZ	Download	Experimental	e6kezA1 e6kezA2 e6kezD1 e6kezP1 e6kezB1 e6kezB2 e6kezC2 e6kezB2 e6kezC1 e6kezC2 e6kezA1 e6kezA2 e6kezD1 e6kezD2 e6kezP1 e6kezE1 e6kezE2 e6kezH1 e6kezF1 e6kezF2 e6kezG1 e6kezG2 e6kezN1 e6kezF2 e6kezG1 e6kezG2 e6kezN1 e6kezE1 e6kezE2 e6kezH1 e6kezH2	FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Long alpha-hairpin Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like Long alpha-hairpin Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Long alpha-hairpin FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Long alpha-hairpin Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like	LigPlot
3QV1	Download	Experimental	e3qv1A1 e3qv1A2 e3qv1D1 e3qv1B1 e3qv1B2 e3qv1C1 e3qv1B1 e3qv1C1 e3qv1C2 e3qv1A1 e3qv1A2 e3qv1D1 e3qv1D2 e3qv1E1 e3qv1E2 e3qv1F1 e3qv1F2	FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like	LigPlot
3RVD	Download	Experimental	e3rvdA1 e3rvdA2 e3rvdD1 e3rvdC1 e3rvdB1 e3rvdB2 e3rvdC1 e3rvdC2 e3rvdB1 e3rvdA1 e3rvdA2 e3rvdD1 e3rvdD2 e3rvdH1 e3rvdE1 e3rvdE2 e3rvdF1 e3rvdF2 e3rvdG1 e3rvdG2 e3rvdF1 e3rvdG1 e3rvdG2 e3rvdH1 e3rvdH2 e3rvdE1 e3rvdE2 e3rvdO1 e3rvdO2 e3rvdQ1 e3rvdQ2	FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like	LigPlot