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Hey Mousheng,

  Have you checked your data carefully for twinning??  I am a new
graduate student and dont have alot of experience but from what I
understand certain forms of twinning can go undetected during structure
solution but can hinder your refinement.... hope this helps.

Sean



On Fri, 25 Aug 2006 18:51:40 +0800
 "Wu Mousheng" <[EMAIL PROTECTED]> wrote:
> 
> 
> Dear all,
> 
>  
> 
> I am refining my model with 2.0A using CNS. I have fitted most of the
> protein sequence into the model (150 of 160 aa). I also added 100
> water
> molecules into the model. The final R and Rfree factor are about 26%
> and
> 28%, respectively. I am wondering why I can not refine my model to
> low R
> and Rfree factors below 25%.  The geometry of my final model is very
> good. 96% residues are in most favorable region. 
> 
>  
> 
> I think my data is quite good. I/sigma(unaverage) and completeness at
> highest resolution shell is 2.3 and 99%. Rmerge is about 6%.
> Redundancy
> is about 5.
> 
>  
> 
> Is my model acceptable based on the R and Rfree factors? Is there any
> reason for the high R and Rfree factors?
> 
>  
> 
> Thanks!
> 
>  
> 
> Best,
> 
> Mousheng Wu,
> 
> Institute of Molecular and Cell Biology, Singapore
> 
>  
> 
> 
> 
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