Dear All,

I'm currently in the process of refining a low(ish) resolution structure at
3.2 Ang, with a fair level of anisotropy. I processed the data through the
anisotropy server (https://services.mbi.ucla.edu/anisoscale/), which
elliptically truncated the data to 4.0, 3.8 and 3.2 Ang. This really
improved the maps and allowed me to trace the majority of the chain and
build most side chains.

The R-factors are reasonable (0.29 work and 0.35 free respectively). but
I'm having trouble with over fitting in refinement as I continue to refine.
What parameters/restraints would the community generally use when refining
this kind of structure? Additionally Refmac doesn't seem to read the
structure factors from the anisotropy server output file properly, giving
vastly inflated R values and strange looking maps.

Cheers,

Rhys

-- 
Dr Rhys Grinter
Sir Henry Wellcome Fellow
Monash University
+61 (0)3 9902 9213
+61 (0)403 896 767

Reply via email to