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 P00325

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1HDX	Download	Experimental	e1hdxA1 e1hdxA2 e1hdxB2 e1hdxB1 e1hdxA2 e1hdxB2	GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like	LigPlot
1HDY	Download	Experimental	e1hdyA1 e1hdyB2 e1hdyA2 e1hdyB1 e1hdyB2 e1hdyA2	GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like	LigPlot
1DEH	Download	Experimental	e1dehA1 e1dehB2 e1dehA2 e1dehB1 e1dehB2 e1dehA2	GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like	LigPlot
1HTB	Download	Experimental	e1htbA1 e1htbB2 e1htbA2 e1htbB1 e1htbB2 e1htbA2	GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like	LigPlot
1HSZ	Download	Experimental	e1hszA1 e1hszA2 e1hszB2 e1hszB1 e1hszA2 e1hszB2	GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like	LigPlot
1U3V	Download	Experimental	e1u3vA1 e1u3vA2 e1u3vB2 e1u3vB1 e1u3vA2 e1u3vB2	GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like	LigPlot
3HUD	Download	Experimental	e3hudA1 e3hudB2 e3hudA2 e3hudB1 e3hudB2 e3hudA2	GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like	LigPlot
1HDZ	Download	Experimental	e1hdzA1 e1hdzB2 e1hdzA2 e1hdzB1 e1hdzB2 e1hdzA2	GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like	LigPlot
1U3U	Download	Experimental	e1u3uA1 e1u3uA2 e1u3uB2 e1u3uB1 e1u3uA2 e1u3uB2	GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like	LigPlot