PDB ligand accession: NAD
DrugBank: DB14128
PubChem: 5892;5288979;10897651;73415790;
ChEMBL:
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
- Class: (5'->5')-dinucleotides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3RUE | Download | Experimental | e3rueA1 e3rueB1 e3rueS1 e3rueb1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
3RUH | Download | Experimental | e3ruhA1 e3ruhB1 e3ruhC1 e3ruhD1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
3RUD | Download | Experimental | e3rudA1 e3rudB1 e3rudC1 e3rudD1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
3RU7 | Download | Experimental | e3ru7A1 e3ru7B1 e3ru7C1 e3ru7D1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
3LU1 | Download | Experimental | e3lu1A1 e3lu1B1 e3lu1C1 e3lu1D1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
3RU9 | Download | Experimental | e3ru9A1 e3ru9B1 e3ru9C1 e3ru9D1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
3RUC | Download | Experimental | e3rucA1 e3rucB1 e3rucC1 e3rucD1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
3RUF | Download | Experimental | e3rufA1 e3rufB1 e3rufS1 e3rufb1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
3RUA | Download | Experimental | e3ruaA1 e3ruaB1 e3ruaC1 e3ruaD1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |