[ccp4bb] Looking for the following values...

2011-01-13 Thread J. Fleming
Hi All, I'm about ready to deposit my structure and have used pdb_extract to aid in the process. Unfortunately the following values were not found and are required by ADIT: 1) Under Data Collection, Reflections section: Observed criterion sigma(F) and Observed criterion sigma(I) 2) Under

Re: [ccp4bb] Looking for the following values...

2011-01-13 Thread gauri misra
Hi, Generally if we use CCP4i we can find these details easily in scala log files. Gauri On Thu, Jan 13, 2011 at 2:48 PM, J. Fleming jonathan...@hotmail.com wrote: Hi All, I'm about ready to deposit my structure and have used pdb_extract to aid in the process. Unfortunately the following

Re: [ccp4bb] Looking for the following values...

2011-01-13 Thread Phil Jeffrey
On 1/13/11 2:48 PM, J. Fleming wrote: Hi All, I'm about ready to deposit my structure and have used pdb_extract to aid in the process. Unfortunately the following values were not found and are required by ADIT: 1) Under Data Collection, Reflections section: Observed criterion sigma(F) and

Re: [ccp4bb] Looking for the following values...

2011-01-13 Thread Pavel Afonine
Hi Jon, a partial answer: 2) Under Refinement, Refinement Statistics section: Number unique reflections (all) I looked in my log files for HKL2000, PHASER, and PHENIX but am confused on where to find the required values above. I tried searching the logs for the mmCIF items but that

Re: [ccp4bb] Looking for the following values...

2011-01-13 Thread Matthew Franklin
89 Convent Avenue, New York, NY 10027 (646) 275-7165 _ From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of J. Fleming Sent: Thursday, January 13, 2011 2:49 PM To: CCP4BB@JISCMAIL.AC.UK Subject: [ccp4bb] Looking for the following values... Hi All, I'm about ready

Re: [ccp4bb] Looking for the following values...

2011-01-13 Thread Edward A. Berry
I find this confusing also! Phil Jeffrey wrote: On 1/13/11 2:48 PM, J. Fleming wrote: Hi All, I'm about ready to deposit my structure and have used pdb_extract to aid in the process. Unfortunately the following values were not found and are required by ADIT: 1) Under Data Collection,