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We revise the regular expressions of previously annotated MAPK docking patterns in order to provide a subtype independent motif that annotates all HIV proteins.
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Other findings around docking patterns are not reported in this article because of space constraints, but they will be reported in a future publication.
In order to further support the feasibility of our new docking patterns as MAPK docking sites, we compared the structures of the HIV matrix protein to those of ERK1/2 substrates.
Multiple consensus MAPK substrate docking patterns have been proposed for eukaryotes, although some exceptions to these patterns do exist [13].
Some of the most frequently observed subtypes of HIV proteins MA, Tat, and Vif are missing the docking pattern most often observed in eukaryotic MAPK substrates, whereas Rev does not show the docking pattern on any strains.
The functional significance of this spatial SV docking pattern remains unclear.
Docking happens in a two-stage process.
The experimental findings were complemented by QSAR modeling and molecular docking study to elucidate the contributing factors responsible for their activities and binding patterns in ligand-receptor complexes.
Molecular docking indicated differential resistance pattern of blaTEM variants.
AutoDock is a popular and efficient docking tool that we have used previously in docking experiments.
Docking calculations via the CDOCKER docking module in DS2.1 can accurately simulate the docking of small molecules to the active sites of macromolecules.
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