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 |
---|---|---|---|---|---|
3JV7 | Download | Experimental | e3jv7A1 e3jv7A2 e3jv7D1 e3jv7B1 e3jv7B2 e3jv7C2 e3jv7B1 e3jv7C1 e3jv7C2 e3jv7A1 e3jv7D1 e3jv7D2 | Rossmann-like GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like Rossmann-like GroES-like | LigPlot |
2XAA | Download | Experimental | e2xaaA1 e2xaaA2 e2xaaD1 e2xaaB1 e2xaaB2 e2xaaC2 e2xaaB2 e2xaaC1 e2xaaC2 e2xaaA2 e2xaaD1 e2xaaD2 | GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like Rossmann-like GroES-like | LigPlot |