PDB ligand accession: JUK
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: KUXUMXOWEWRGNF-AWEZNQCLSA-O
SMILES: c1cc(oc1)C[n+]2c(c(cc3c2N=C4C=CC=CN4C3=O)C(=O)NCC5CCCO5)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridopyrimidines
- Subclass: Pyrido[2,3-d]pyrimidines
- Class: Pyridopyrimidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6JAY | Download | Experimental | e6jayA1 e6jayA2 | FKBP-like TIM beta/alpha-barrel | LigPlot |