Dear Jacob, I do not have exactly what you are asking about but some clues.
I am not fond of using buried surface area as an indicator of anything in particular and always use energy estimates, however unreliable they may be. In J.Comp.Chem. 31(1),133-143, I put a probability plot for PISA to give erroneous oligomeric states as a function of complex's free energy (page 141, long-dashed line). In page 138, there's a plot showing correlation between free energy (as estimated by PISA) and buried surface energy. Combining the two, you may get a rough answer to your question :) Hope this helps, Eugene. On 26 May 2011, at 03:41, Jacob Keller wrote: > Dear Crystallographers, > > is anyone aware of a reference or plot addressing buried surface area > (or PISA output values) versus veracity of a complex? I am trying to > determine the physiological relevance of a > crystallographically-observed assembly, and would love to put my PISA > output in the context of verified complexes versus crystal contacts. > > Thanks, > > Jacob > > ******************************************* > Jacob Pearson Keller > Northwestern University > Medical Scientist Training Program > cel: 773.608.9185 > email: j-kell...@northwestern.edu > *******************************************
