[ccp4bb] Job Post - PostDoc position (CSSB, Hamburg, Germany) for the project ‘Structural and mechanistic studies of functional protein fibrils using correlative electron and light microscopy’

2020-03-19 Thread Landau Meytal
Dear CCP4 scientists, This is a joint collaborative project between Israel and the University of Hamburg on the "mechanisms governing virulence and antibacterial properties of protein fibrils in infectious and aggregation disease"s. The research methods include single particle cryoEM reconstru

Re: [ccp4bb] displyaing cryo-EM map in pymol

2020-03-19 Thread Steve Chou
Hi George, The following commands use to work for me. = # on computer terminal gzip ~/Desktop/pore_loops/myProt.mrc # compress .mrc file into .gz file; it will generate a file named myProt.mrc.gz load the pdb into PyMOL # on PyMOL terminal hide all show cartoon set cartoon_oval_length

[ccp4bb] displyaing cryo-EM map in pymol

2020-03-19 Thread George Lountos
I wanted to ask if anyone has a good reference or tutorial link for displaying and working with cryo-EM map files in pymol. Thanks, George To unsubscribe from the CCP4BB list, click the following link: https://www.jiscma

Re: [ccp4bb] Coot under WSL2

2020-03-19 Thread Clement Degut
Immediate update : If you use VcXserv, you need to start it with all default option, and generate a config file. Then change in the file wgl to False. Restart computer (yes) And start VcXserv with the modified config. If you simply deactivate native openGl via the gui nothing is working anymore fo

Re: [ccp4bb] Coot under WSL2

2020-03-19 Thread Clement Degut
The performance are massively improved in WSL2 versus WSL1, so maybe it's why you had bad memory of it ? WSL2 is currently only available in insider fast ring, but will be for everyone with next major update (v2004) in few weeks. The main problem is, while you can use the right toolbar by simply d

Re: [ccp4bb] Coot under WSL2

2020-03-19 Thread Paul Emsley
On 19/03/2020 12:43, Clement Degut wrote: I have been recently trying to use ccp4 in windows subsystem for Linux 2 (Ubuntu distribution), everything i tried run perfectly smoothly, including graphical interfaces. I am pleasantly surprised - when I tried that (some time ago) the graphics perfo

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Filipe Maia
Dear Colleagues, I would like to add my voice to those advocating making available raw diffraction images and point out another resource for raw data deposition, https://cxidb.org, particularly for the case of emerging methods such as serial crystallography. Cheers, Filipe On Thu, 19 Mar 2020 at

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Harry Powell - CCP4BB
Hi > While those text files would be heavy, they'd be still lighter than raw > images and the whole useless white space they carry with them between > reflections. At the risk of extending this thread into a different direction, the "white space (the images) carry with them between reflections

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Andreas Förster
This last, very important point made by Graeme gives me the chance to plug a satellite workshop at the IUCr Congress (end of August, so fingers crossed that this will go ahead) on "MX raw image data formats, metadata and validation". This is organized by Herbert Bernstein, Loes Kroon-Batenburg, Br

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread John Berrisford
Dear all The wwPDB OneDep system allows depositors to provide DOIs of raw diffraction images during deposition to the PDB and once again encourages depositors to provide a DOI for raw images when they have submitted. Out of the 9665 X-ray entries that were released in 2019 we have DOI's for raw

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Joel Sussman
19-Mar-2020 Dear Loes, Peter, Clemens & Gerard, I concur that it is crucial to preserve the original diffraction data and make it available to anyone who would like to use it. As an example, please see the very recent paper by Nachon et al (2020). "A second look at the crystal structures of Dros

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Clemens Vonrhein
Dear Julien, On Thu, Mar 19, 2020 at 08:47:20AM +, Julien Cappèle wrote: > Though I agree with you Clemens that raw images are amazing to work > with as you can use any software you are confortable with, we cannot > forget that depositing several TB of data for each lab would be bad > for ecol

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Peter Keller
Dear all, On Thu, 19 Mar 2020, Winter, Graeme (DLSLtd,RAL,LSCI) wrote: Date: Thu, 19 Mar 2020 09:08:21 From: "Winter, Graeme (DLSLtd,RAL,LSCI)" To: CCP4BB@JISCMAIL.AC.UK Subject: Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures No matter how much data we produce, the pa

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Kroon-Batenburg, L.M.J. (Loes)
Dear Gerard, This is a great idea. Of course I am very much in favour of making available raw diffraction images, and such a virtual workshop could demonstrate the usefulness of reprocessing raw diffraction data and structural refinements. I am not at all afraid that archiving of raw data that

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Winter, Graeme (DLSLtd,RAL,LSCI)
Hi Folks, Quick note on "Like a super raw image diet-plan for the incoming summer” - the bslz4 compression used with Eiger works really well, and the data are pretty close to entropy limit in terms of size - which means if you measure your data carefully (i.e. low background etc.) you can reali

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Julien Cappèle
Hi everyone, There are some very interesting ideas. Though I agree with you Clement that raw images are amazing to work with as you can use any software you are confortable with, we cannot forget that depositing several TB of data for each lab would be bad for ecological reason. And because d

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Andreas Förster
Hi Clemens, this is curious. You are right that there's a direct link to the raw data on 6vs4, but there isn't one on http://www.rcsb.org/structure/6H56. I'll contact RCSB to see where the problem lies. All best. Andreas On Thu, Mar 19, 2020 at 8:34 AM Clemens Vonrhein wrote: > Hi Andrea

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Clemens Vonrhein
Dear Petr, On Thu, Mar 19, 2020 at 06:45:31AM +, Petr Kolenko wrote: > For those of you who are in touch with these data, would deposition > of unmerged intensities in P1 in the whole detector range instead of > complete dataset be good enough to „correctly“ re-evaluete the > structure? Or is

Re: [ccp4bb] Raw diffraction images for SARS-CoV-2 related structures

2020-03-19 Thread Clemens Vonrhein
Hi Andreas, On Thu, Mar 19, 2020 at 07:06:32AM +0100, Andreas Förster wrote: > - The link to the raw data can be found inside the mmCIF file under > _pdbx_related_exp_data_set.data_reference. Whether it's also shown on one > of the PDB sites is up to the designers of these sides. I cannot find a