PDB ligand accession: NCN
DrugBank: DB02382
PubChem: 121991;5288991;
ChEMBL: n/a
InChI Key: JOUIQRNQJGXQDC-ZYUZMQFOSA-N
SMILES: c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)(O)[O-])O)O)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: Pyridine nucleotides
- Subclass: Nicotinic acid nucleotides
- Class: Pyridine nucleotides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5AYZ | Download | Experimental | e5ayzA2 e5ayzB1 e5ayzC2 e5ayzD2 e5ayzE1 e5ayzF2 e5ayzG1 e5ayzH1 e5ayzI2 e5ayzJ1 e5ayzK1 e5ayzL1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |