[ccp4bb] Alternative conformation in Mac Refmac5

2009-09-11 Thread Heidi Tuominen 
Hi all,

I have updated lately to ccp4-6.1.2. I have Macintosh. Now I have problem with 
alternative conformations. After Refmac5 run all alternative conformation atoms 
are fully unordered without any chemical restraints. If I put same pdb to 
Windows Refmac5.5.0102 there is no any problems except R-factors are some 
higher.

Do I have some problem or is there bug in Mac version of Refmac5.5.0102? How 
problem could be solved?

Thank you,
Heidi Tuominen
University of Turku, Finland

Re: [ccp4bb] Alternative conformation in Mac Refmac5

2009-09-11 Thread Roberto Steiner 

Hi Heidi,

I have noticed the same thing. Went back to Refmac v93 (mac version)  
and side-chains stopped flying. Needs a fix.


Best
Roberto
On 11 Sep 2009, at 10:59, Heidi Tuominen wrote:


Hi all,

I have updated lately to ccp4-6.1.2. I have Macintosh. Now I have  
problem with alternative conformations. After Refmac5 run all  
alternative conformation atoms are fully unordered without any  
chemical restraints. If I put same pdb to Windows Refmac5.5.0102  
there is no any problems except R-factors are some higher.


Do I have some problem or is there bug in Mac version of  
Refmac5.5.0102? How problem could be solved?


Thank you,
Heidi Tuominen
University of Turku, Finland