Sentence examples for binding modes for the from inspiring English sources

Using engineered trypsin variants, we find similar overall binding modes for the (E,Z) and (Z,Z) isomers.

Molecular docking study with dual inhibitor 6e also suggested plausible binding modes for the ALR1 and ALR2 enzymes.

Comparison of all variant activities on each substrate indicated different binding modes for the three aromatic substrates, supported by computational docking.

Diverse ligands with distinct scaffolds modulating one target may represent alternative binding modes for the same active site, but on occasion may also indicate binding at an allosteric site or a pharmacologically distinct function.

Small clusters indicate that AD4 had difficulty in consistently determining binding modes for the larger compounds in the DUD library.

In order to characterize the binding modes for the PLMs, a co-crystal structure of one, JTH-NB72-39, was determined, which possesses components that have been independently reported to directly interact with the active site of the BoNT/A LC [35], [39], [40].

However, because our docking workflow specifically identified compounds that were predicted to be HLA binders in presence of all three peptides P1, P2, and P3, we wanted to specifically examine and analyze the binding modes for those hit compounds.

A molecular docking study was conducted, and the results showed a consistent and stable binding mode for the typical compounds.

We use chemical proteomics to discover an unusual binding mode for the DGKα inhibitor, ritanserin, including interactions at the atypical C1 domain distinct from the ATP binding region.

The docking mode of 2 with the catalytic domain of TACE was illustrated to analyze the binding mode for the further analogue design.

We also mapped the binding mode for the reported, virtually generated proline analogs and compared it with the reported crystal structure.