PDB ligand accession: 3NJ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: MARYQJLDFKFFCO-UHFFFAOYSA-N
SMILES: C1=CC(=O)OC(=O)C=C1F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organohalogen compounds
- Class: Aryl halides
- Subclass: Aryl fluorides
- Class: Aryl halides
- Superclass: Organohalogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4WHR | Download | Experimental | e4whrA1 e4whrB1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |