Ligand name: 7-THIONICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
PDB ligand accession: TAP
DrugBank: DB01763
PubChem: 5289437;131704180;
ChEMBL: CHEMBL1236188
InChI Key: OJNFDOAQUXJWED-NNYOXOHSSA-N
SMILES: c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)OP(=O)(O)O)O)O)O)C(=S)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 Q13423

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1PT9	Download	Experimental	e1pt9A1 e1pt9B1	Rossmann-like Rossmann-like	LigPlot