Dear community,
The protein model I am refining has 400 amino acids (3320 atoms).
Some real quick calculations tell me that to properly refine it
anisotropically, I would need 119,520 observations. Given my unit-cell
dimension and space-group it is equivalent to about a 1.24 A complete data
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Dear,
1.24A resolution is reasonable for anisotropic refinement - including
restraints you have more observations than the number of reflections,
so just doing the calculation does not give a concise answer!
You should try and see if the refinement
On Monday, September 17, 2012 11:31:53 am Yuri Pompeu wrote:
Dear community,
The protein model I am refining has 400 amino acids (3320 atoms).
Some real quick calculations tell me that to properly refine it
anisotropically, I would need 119,520 observations. Given my unit-cell
dimension
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From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of
Yuri Pompeu
Sent: Monday, September 17, 2012 20:32
To: CCP4BB@JISCMAIL.AC.UK
Subject: [ccp4bb] B-iso vs. B-aniso
Dear community,
The protein model I am refining has 400 amino acids (3320 atoms).
Some real quick
