PDB ligand accession: HB8
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: WAKYUFAFDTZJQR-UHFFFAOYSA-N
SMILES: [B-](c1cc2cccc(c2s1)NC(=O)OC(C)(C)C)(O)(O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzothiophenes
- Subclass: 1-benzothiophenes
- Class: Benzothiophenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6IBS | Download | Experimental | e6ibsA1 e6ibsB1 | Metallo-hydrolase/oxidoreductase Metallo-hydrolase/oxidoreductase | LigPlot |