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Re: [ccp4bb] Alternate space groups for MR in Beast |
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CCP4bb navigationCCP4bb <-- 1999 <-- November 1999 <-- 30 November 1999Subject: Re: Alternate space groups for MR in Beast From: Roger Rowlett RRowlett {- at -} MAIL {- dot -} COLGATE {- dot -} EDU Date: 2007-05-07 Ed, I would highly recommend Phaser to do what you want. Phaser can be configured to search all possible related space groups, or the ones you designate. Open-EPMR can also do automated related space-group searching as well. Cheers, ___________________________________________ Roger S. Rowlett Professor Department of Chemistry Colgate University 13 Oak Drive Hamilton, NY 13346 tel: (315)-228-7245 ofc: (315)-228-7395 fax: (315)-228-7935 email: rrowlett@mail.colgate.edu -----Original Message----- From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of Edward A. Berry Sent: Monday, May 07, 2007 2:32 PM To: CCP4BB@JISCMAIL.AC.UK Subject: [ccp4bb] Alternate space groups for MR in Beast Dear All, I'm doing molecular replacement with beast, using the ccp4i gui. Space group is P41 or P43 based on syst. absences. Input mtz file is reduced in P41, but I want to try the translation search with both. So, Does beast automatically try both? Is there a parameter I can enter to set p43 on second run? Do I need to change space group of input file to test p43? Thanks, Ed CCP4bb navigationCCP4bb <-- 1999 <-- November 1999 <-- 30 November 1999 |
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