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 |
---|---|---|---|---|---|
4I4B | Download | Experimental | e4i4bB1 e4i4bB2 e4i4bA2 e4i4bA3 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits RuvA-C | LigPlot |
1QAY | Download | Experimental | e1qayB1 e1qayB2 e1qayA2 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |
1QAX | Download | Experimental | e1qaxA3 e1qaxA4 e1qaxB1 e1qaxB2 | RuvA-C Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |