Dear Robbie and Tim， Thanks a lot for your reply. I just do not understand that if we can change the R free set during different rounds of refinement, the gap between Rwork and Rfree would be small, and Rfree would be meaningless, as R-free set is not "free".
Best regards, Qixu Cai Email: caiq...@gmail.com Robbie Joosten <robbie_joos...@hotmail.com> 于2023年4月28日周五 15:26写道： > Hi Qixu, > > PDB-REDO tries to have a minimum number test set reflections to reduce the > error margin in R-free. As Tim says this is not a problem but if you reach > out privately we can change your calculation to use your current testset. > That is not recommended though. > > Cheers, > Robbie > > On 28 Apr 2023 04:51, Qixu Cai <caiq...@gmail.com> wrote: > > Dear all, > > I'm using the PDB-REDO server to refine my structure. I found that > PDB-REDO said that 5% R-free set is too small and it created a new R-free > set. > > Is possible for the PDB-REDO server to keep the original R-free set to > make final Rfree value comparable? > > Best regards, > > Qixu Cai > Email: caiq...@gmail.com > > > ------------------------------ > > To unsubscribe from the CCP4BB list, click the following link: > https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB&A=1 > > > ######################################################################## To unsubscribe from the CCP4BB list, click the following link: https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB&A=1 This message was issued to members of www.jiscmail.ac.uk/CCP4BB, a mailing list hosted by www.jiscmail.ac.uk, terms & conditions are available at https://www.jiscmail.ac.uk/policyandsecurity/
