Question: Animation Of Changes In 3D Protein Conformation Due To Ph Change?
gravatar for Egon Willighagen
6.3 years ago by
Egon Willighagen5.1k wrote:

Eric Martz was wondering on the Jmol mailing list if there are animations around of 3D conformational changes of protein structures due to changes in the pH?

protein • 1.3k views
ADD COMMENTlink modified 4.3 years ago by Biostar ♦♦ 20 • written 6.3 years ago by Egon Willighagen5.1k

I spent some time looking through the literature to try and answer this, because I found it pretty interesting, but I found very little. I looked through a bunch of papers on constant pH charmm simulations, but none provided movies. It seems like only one in 10 or 20 MD papers do anyway.

ADD REPLYlink written 6.3 years ago by Keith Callenberg870

You can have a look at ion channels simulations and normal modes analysis. Specially acid sensing ion channels, activated by protons.

ADD REPLYlink written 4.3 years ago by quentin.delettre420
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