PDB ligand accession: 1C0
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BYQYZNOLMVIJLY-UHFFFAOYSA-N
SMILES: B1(c2c(cc(cc2F)CN(c3cc4c(cc3C5CC5)c(c(o4)c6ccc(cc6)F)C(=O)NC)S(=O)(=O)C)CO1)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: 2-arylbenzofuran flavonoids
- Subclass: None
- Class: 2-arylbenzofuran flavonoids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4KBI | Download | Experimental | e4kbiA1 e4kbiA2 e4kbiB1 e4kbiB2 | helical bundle domain in reverse transcriptase-like polymerases Alpha-beta plaits helical bundle domain in reverse transcriptase-like polymerases Alpha-beta plaits | LigPlot |