Ligand name: 3-ACETYLPYRIDINE ADENINE DINUCLEOTIDE
PDB ligand accession: A3D
DrugBank: DB03363
PubChem: 123926;131704240;
ChEMBL: n/a
InChI Key: KPVQNXLUPNWQHM-RBEMOOQDSA-N
SMILES: CC(=O)c1ccc[n+](c1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)O)O)O)O
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 P90613

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1PZG	Download	Experimental	e1pzgA3 e1pzgA2 e1pzgB3 e1pzgB2 e1pzgC1 e1pzgC2 e1pzgD1 e1pzgD2	LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like	LigPlot
1PZF	Download	Experimental	e1pzfA3 e1pzfA2 e1pzfB1 e1pzfB2 e1pzfC3 e1pzfC2 e1pzfD3 e1pzfD2	LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like	LigPlot