Ligand name: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE
PDB ligand accession: NAI
DrugBank: DB00157
PubChem: 439153
ChEMBL: CHEMBL1234616
InChI Key: BOPGDPNILDQYTO-NNYOXOHSSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=CCC(=C5)C(=O)N)O)O)O)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 drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P09622

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1ZMD	Download	Experimental	e1zmdA1 e1zmdA2 e1zmdA3 e1zmdB1 e1zmdB1 e1zmdB2 e1zmdB3 e1zmdC1 e1zmdC2 e1zmdC3 e1zmdC1 e1zmdD1 e1zmdD2 e1zmdD3 e1zmdE1 e1zmdE2 e1zmdE3 e1zmdF1 e1zmdF2 e1zmdF3 e1zmdG2 e1zmdG3 e1zmdF3 e1zmdG1 e1zmdG2 e1zmdG3 e1zmdH1 e1zmdH2 e1zmdH3	FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like	LigPlot