PDB ligand accession: TNF
DrugBank: DB03651
PubChem:
ChEMBL:
InChI Key: OXNIZHLAWKMVMX-UHFFFAOYSA-N
SMILES: c1c(cc(c(c1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenols
- Subclass: Nitrophenols
- Class: Phenols
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5K1W | Download | Experimental | e5k1wA1 | TIM beta/alpha-barrel | LigPlot |
5K1U | Download | Experimental | e5k1uA1 | TIM beta/alpha-barrel | LigPlot |