PDB ligand accession: K2N
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: XXBDOTXPQDVHIP-JTQLQIEISA-N
SMILES: CCOC(=O)Nc1cc2c(c(n1)N)N=C(C(N2)C)c3ccccc3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Aminopyridines and derivatives
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3N2K | Download | Experimental | e3n2kA3 e3n2kA4 e3n2kB1 e3n2kB2 e3n2kD3 e3n2kD4 e3n2kC4 | Bacillus chorismate mutase-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like Rossmann-like | LigPlot |