Re: [ccp4bb] Some ccp4i2 menu options seem missing.

2019-04-24 Thread Jonathan Cooper
[SOLVED] Sorry folks, that was an easy one, "Clone Job" sorted it. Thanks for the tip Huw. Sent from Yahoo Mail on Android On Wed, 24 Apr 2019 at 23:14, Huw Jenkins<288da93ae744-dmarc-requ...@jiscmail.ac.uk> wrote: Hi, > On 24 Apr 2019, at 22:42, Jonathan Cooper > <0c2488af9525-

Re: [ccp4bb] Some ccp4i2 menu options seem missing.

2019-04-24 Thread Huw Jenkins
Hi, > On 24 Apr 2019, at 22:42, Jonathan Cooper > <0c2488af9525-dmarc-requ...@jiscmail.ac.uk> wrote: > > Any clues much appreciated, otherwise I'm back to the old gui. The linux one looks like a job that has been run. If you got to the task menu and click on Refinement - REFMAC5 does the n

[ccp4bb] Some ccp4i2 menu options seem missing.

2019-04-24 Thread Jonathan Cooper
Hello, on linux (Lubuntu) my install of the latest ccp4i2 does not allow me to change certain options, e.g. from isotropic to anisotropic refinement:  www.ucl.ac.uk/~rmhajc0/jbc.jpg whereas my spy with a Mac gets: www.ucl.ac.uk/~rmhajc0/jg.jpg and the desired options are there and working.  Any

[ccp4bb] Scientist/Investigator BioNMR position - Novartis

2019-04-24 Thread Bussiere, Dirksen
Colleagues: This might be a bit off-topic, but is still biophysics related. We are looking for a research associate or investigator to join our group in the area of biological NMR. The job advertisement follows, as does the link which will allow you to apply. Please don't send me your CV, r

Re: [ccp4bb] “Bound ligand” versus “modified residue”

2019-04-24 Thread Nigel Moriarty
The "CYS with" means that the main chain is restrained and treated the same as "normal" CYS. However, I'm not sure how the sequence should be handled in the file especially mmCIF. Maybe John Berrisford can comment. Cheers Nigel --- Nigel W. Moriarty Building 33R0349, Molecular Biophysics and In

Re: [ccp4bb] “Bound ligand” versus “modified residue”

2019-04-24 Thread Pavel Afonine
Hi Ian, perhaps there are as many answers to this as many subscribers to this list, but personally "Cysteine with attachment" seems more logic and clear to me than calling the whole thing a different name. Although I would also understand arguments like if it is a CYS with an attachment it is not r

[ccp4bb] Protein Crystallography Summer School at York, 1-7 September 2019

2019-04-24 Thread Johan Turkenburg
This year the University of York will be hosting a Protein Crystallography Summer School, sponsored by CCP4 and others, which will take place 1-7 September. (This school has previously been held biennially in St Andrews.) The course aims to cover the theoretical and practical aspects of protein

[ccp4bb] “Bound ligand” versus “modified residue”

2019-04-24 Thread Ian Clifton
Hello everyone, PDB structure 4qdu contains a “modified residue”, 30V. This is joined into the rest of the main chain by means of LINK records. In 5kwj, a similar type of modification is described as a cysteine with a side‐chain LINK to its “bound ligand”, 6Y3 . (These structures are just two clea

[ccp4bb] 2 positions around XChem-related compound design

2019-04-24 Thread Frank von Delft
Dear all, I have two open to work on fragment/XChem-related methodology for structure-based compound design. Team Leader (applications close next *Weds 1st May*):  full ad here , summary: /We are recruiting an experienced

[ccp4bb] PhD program in Austria -HIRING NOW

2019-04-24 Thread Oberer, Monika (m.obe...@uni-graz.at)
Dear Colleagues, The fully-funded PhD program "Molecular Metabolism - MOBILES" is currently hiring motivated PhD candidates for positions in Graz, Austria. Besides being a dynamic place for science, Graz is regularly ranked among the European cities with the best quality of living, and a lively

[ccp4bb] AW: [ccp4bb] Off topic - French Press Accessories

2019-04-24 Thread Hughes, Jon
hi naza, i wouldn't touch machines like that from the USA – their prices are too high and their tolerances are miserable. we bought a made-to-measure French press (including various stainless-steel cells) from a REAL hydraulics manufacturer near here https://watzhydraulik.de/en/ about 20 years

[ccp4bb] AW: [ccp4bb] Off topic - French Press Accessories

2019-04-24 Thread Linnert, Dr. Miriam
Dear Nazahiyah, there is a small german company which sells the the former Thermo French press further. There we got three years ago a new larger cell. http://www.gheinemann.de/htu-digi-french-press.html But I think unfortunately the homepage works so far only in german. Hope I could help you.