Sculpting protein conformations: Difference between revisions

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Sometimes it is instructive to change the conformation of a protein model. Typically this means "sculpting" an experimentally-determined (empirical) model into a hypothetical conformation with some functional significance<ref name="transition-paths">PMID:31435895</ref>. Here are described software packages that enable this to be done manually, using the mouse to drag portions of the original model into desired conformations.
Sometimes it is instructive to change the conformation of a protein model. Typically this means "sculpting" an experimentally-determined (empirical) model into a hypothetical conformation with some functional significance<ref name="transition-paths">PMID:31435895</ref>. Here are described software packages that enable this to be done manually, using the mouse to drag portions of the original model into desired conformations.


As you sculpt a protein model, you are morphing it into a new conformation. However, [[Morphs|molecular morphing]] usually means saving a movie or animation that shows interpolated transitioning between two earlier-saved conformations, which may be empirical or theoretical. There are [[Morphs|many examples of molecular morphs]] in Proteopedia. Slides explaining how to morph a sculpted protein are available at [http://tinyurl.com/sculpting-proteins tinyurl.com/sculpting-proteins].
As you sculpt a protein model, you are morphing it into a new conformation in real time. However, [[Morphs|molecular morphing]] usually means saving a movie or animation that shows interpolated transitioning between two earlier-saved conformations, which may be empirical or theoretical. There are [[Morphs|many examples of molecular morphs]] in Proteopedia. Slides explaining how to morph a sculpted protein are available at [http://tinyurl.com/sculpting-proteins tinyurl.com/sculpting-proteins].




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Eric Martz