null
SMILES: Fc1ccc(cc1)C(C#N)c1cccc(n1)C(F)(F)F
InChI Key: InChIKey=DXQNDKQUHKVTTC-UHFFFAOYSA-N
PDB links: 1 PDB ID matches this monomer.
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Acyl-homoserine lactone acylase PvdQ [A190E,F674L] (Pseudomonas aeruginosa) | BDBM113772 (2-(4-Fluorophenyl)-2-(6-(trifluoromethyl)pyridin-2...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase MCE PC cid PC sid PDB UniChem Similars | PDB Article PubMed | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
The Broad Institute , Cambridge, Massachusetts 02142, United States | Assay Description The assay was performed with nine compound concentrations that ranged from 3 nM to 19.5 µM with PvdQ concentration of 20 nM. The positive contro... | ACS Chem Biol 9: 1536-44 (2014) Article DOI: 10.1021/cb5001586 BindingDB Entry DOI: 10.7270/Q2PC311M | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |