[ccp4bb] merge weak anomalous signal from multiple datasets

2015-03-01 Thread CPMAS Chen
Dear CCP4 users, Recently, I got some datasets with weak anomalous Br signal. I tried to merge them according to Q. Liu et al Science 336, p1033 (2012). I am using the script multiscale@SSRL. The merged dataset has WEAKER anomalous signals. Liu et al used SCALA for scaling and merging while

Re: [ccp4bb] CCP4BB Digest - 28 Feb 2015 to 1 Mar 2015 (#2015-61)

2015-03-01 Thread Jim Pflugrath
Instead of Br which has a weak signal at its K edge, why not use Iodide at some wavelength (or energy) where it gives a stronger signal? The longer wavelength used will help with spot spatial resolution as well. One may be fighting radiation damage, too. One may be fighting a moving (vibrating?)

Re: [ccp4bb] Skin on drops

2015-03-01 Thread syed ibrahim
In my practice, I never worried about the skin. You need extra care while you mount the crystal. In my case I have used the skin to mount my crystals without any problem. In fact it was much helpful. While mounting, you should not take the crystal covered with the skin. Best Syed

Re: [ccp4bb] Higher Rmerge at lower resolution

2015-03-01 Thread Veronica Pillar
Dear Gerard, Eleanor et al., In the graphs of Rmeas vs. batch number (and I or I/sigma vs. batch number), everything looks roughly constant, which made me think that significant radiation damage was not the issue--but are you saying that radiation damage might also (or instead) produce a smiley

[ccp4bb] Python Developer, 15 months

2015-03-01 Thread David Aragao
Dear All, We are looking for a Python programmer to improve our robot at the MX beamlines, Australian Synchrotron. Details below. Position Title: Senior Controls Engineer (Python Developer), 15 months, fixed term contract position Job Description Reporting directly to a Principal Controls

Re: [ccp4bb] merge weak anomalous signal from multiple datasets

2015-03-01 Thread Andreas Förster
Hi Charles, I don't know what multiscale does. Probably the right thing. If the anomalous signal is weaker after scaling of multiple datasets, non-isomorphism might be at fault. Try Blend to scale your datasets. Blend is part of ccp4 and gives good graphical diagnostic feedback. Andreas

Re: [ccp4bb] Higher Rmerge at lower resolution

2015-03-01 Thread Kay Diederichs
Hi Veronica, as others have said, at RT the radicals travel much further than at cryo temperature, so your lateral shifts are probably not sufficient. But it is not clear to me that radiation damage is to blame at all. To me it sounds like you might have to mask your beamstop better, or you