Re: [ccp4bb] Thanks

2022-02-09 Thread Jon Agirre
Thank you Clare for all your contributions to the community throughout these 25 years, particularly for bringing the technicians' perspective into focus, and providing helpful feedback. You will be missed. Best of luck in your next role, Jon On Wed, 9 Feb 2022 at 09:58, Clare Stevenson (JIC) <

[ccp4bb] Thanks

2022-02-09 Thread Clare Stevenson (JIC)
I have subscribed to the CCP4 bulletin board for over 25 years and attended many CCP4 meetings. I am changing role shortly and will no longer be a crystallographer so will unsubscribe from the board. I just wanted to pass on my thanks to everyone who has written posts, contributed to

Re: [ccp4bb] Thanks and outcome of ([ccp4bb] Looking for method to find similar oligomeric arrangement)

2020-06-22 Thread Jose Duarte
A further note on assembly search: since April the RCSB PDB offers structure search for assemblies. See the "Structure Similarity" section in https://www.rcsb.org/search/advanced. This works only for PDB-deposited structures but we are working on making it available for 3D coordinates submitted by

[ccp4bb] Thanks and outcome of ([ccp4bb] Looking for method to find similar oligomeric arrangement)

2020-06-21 Thread Andrew Lovering
Dear All Many thanks to Johann for the suggestion of Topsearch - rather pleasingly our tetramer is novel in the tetrameric arrangement, but each of the dimers has its DNA recognition helices in agreement with several hits a win all round Bringing joy to my lockdown. Best Andy

[ccp4bb] Thanks!

2017-01-30 Thread Carter, Charlie
Bill, I followed Abraham Szöke’s work from a distance, but never met him. I knew he was imaginative, and that he made original contributions to density modification. I was much moved to read your appreciation of him. Many thanks, Charlie

[ccp4bb] Thanks to informal query respondents

2015-06-10 Thread Bernhard Rupp
Hi Fellows, thanks again to all who took the time to respond (often very extensively) to my queries regarding funding experience and resource distribution. The summary is available now ahead of print: http://www.ncbi.nlm.nih.gov/pubmed/26051321 Let's hope it has some positive

Re: [ccp4bb] Thanks to informal query respondents

2015-06-10 Thread Jurgen Bosch
Your Figure 1 suggest a secret message - or at least I view it that way. The early steps “basic research” seems to be funded by Euros, while the in silico part is funded in Dollars. Or was that unintentional ? Jürgen .. Jürgen Bosch Johns Hopkins University Bloomberg School

Re: [ccp4bb] Thanks for the new graphical CCP4 installer

2013-02-15 Thread eugene . krissinel
Thank you Francois for positive feedback. Eugene On 15 Feb 2013, at 05:40, Francois Berenger wrote: It is easy to use and even nice looking. Regards, F. -- Scanned by iCritical.

[ccp4bb] Thanks for the new graphical CCP4 installer

2013-02-14 Thread Francois Berenger
It is easy to use and even nice looking. Regards, F.

Re: [ccp4bb] thanks god for pdbset

2012-12-05 Thread Ed Pozharski
Francois, I did not realize Phil Evans is god (perhaps a minor one as he did not yet earn a capital G). I do concur that insertion code is evil. I had to re-refine an old antibody structure recently and it messes up coot sequence window and breaks refmac bond restraints. Evil, evil,.evil.

Re: [ccp4bb] thanks god for pdbset

2012-12-05 Thread Phil Evans
not god I don't think I wrote that bit! Phil On 5 Dec 2012, at 15:06, Ed Pozharski wrote: Francois, I did not realize Phil Evans is god (perhaps a minor one as he did not yet earn a capital G). I do concur that insertion code is evil. I had to re-refine an old antibody structure

Re: [ccp4bb] thanks god for pdbset

2012-12-05 Thread Ian Tickle
The last time I tried the pdbset renumber command because of issues with insertion codes in certain programs, it failed to also renumber the LINK, SSBOND CISPEP records. Needless to say, thanking god (or even God) was not my first thought! (more along the lines of why can't software developers

Re: [ccp4bb] thanks god for pdbset

2012-12-05 Thread Robbie Joosten
-Original Message- From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of Ian Tickle Sent: Wednesday, December 05, 2012 16:39 To: CCP4BB@JISCMAIL.AC.UK Subject: Re: [ccp4bb] thanks god for pdbset The last time I tried the pdbset renumber command because of issues

Re: [ccp4bb] thanks god for pdbset

2012-12-05 Thread Ian Tickle
. Cheers, Robbie -Original Message- From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of Ian Tickle Sent: Wednesday, December 05, 2012 16:39 To: CCP4BB@JISCMAIL.AC.UK Subject: Re: [ccp4bb] thanks god for pdbset The last time I tried the pdbset renumber

Re: [ccp4bb] thanks god for pdbset

2012-12-05 Thread Peter Keller
Hi Robbie, On Wed, 2012-12-05 at 17:02 +0100, Robbie Joosten wrote: Hi Ian, It's easy to forget about LINK records and such when dealing with the coordinates (I recently had to fix a bug in my own code for that). The problem with insertion codes is that they are very poorly defined in the

Re: [ccp4bb] thanks god for pdbset

2012-12-05 Thread Ed Pozharski
On Wed, 2012-12-05 at 17:02 +0100, Robbie Joosten wrote: Does 128A come before or after 128? Robbie, shouldn't it simply depend on which residue record comes first in the pdb file? Ed. -- Oh, suddenly throwing a giraffe into a volcano to make water is crazy?

Re: [ccp4bb] thanks god for pdbset

2012-12-05 Thread Robbie Joosten
. In practice, as Ed pointed out, it is a big mess. Cheers, Robbie -Original Message- From: Ian Tickle [mailto:ianj...@gmail.com] Sent: Wednesday, December 05, 2012 17:26 To: Robbie Joosten Cc: CCP4BB@JISCMAIL.AC.UK Subject: Re: [ccp4bb] thanks god for pdbset I had always assumed

Re: [ccp4bb] thanks god for pdbset

2012-12-05 Thread Robbie Joosten
Hi Peter, Thanks for the info. I'd better go check whether my code assumes insertion codes are not digits. Cheers, Robbie Date: Wed, 5 Dec 2012 17:57:58 + From: pkel...@globalphasing.com Subject: Re: [ccp4bb] thanks god for pdbset To: CCP4BB@JISCMAIL.AC.UK Hi Robbie, On Wed

[ccp4bb] thanks god for pdbset

2012-12-04 Thread Francois Berenger
Especially the renumber command that changes residue insertion codes into an increment of the impacted residue numbers. Regards, F.

[ccp4bb] Thanks for the many responses

2010-06-10 Thread Nicholas Keep
Thanks for the many responses. I had been setting the parameters right. The problem was I was not telling xds to go back as far as INIT in the reprocessing. JOB ALL was the answer Best wishes Nick -- Prof Nicholas H. Keep Executive Dean of School of Science Professor of Biomolecular Science

[ccp4bb] THANKS Cryo Shipping!!

2010-04-15 Thread xaravich ivan
Thanks everyone for letting me know its canister. I had a different idea of a canister. I really appreciate all your replies.Instead of replying individually, I am sending this common email. Thanks again, Ivan

[ccp4bb] Thanks: Phylogenetic analysis??

2008-11-07 Thread Raji Edayathumangalam
Thanks to all who responded. I was able to somewhat generate the info I needed. Raji

[ccp4bb] Thanks for the many responses concerning protein concentration

2008-08-23 Thread Mark Hilge
Dear colleagues, Thanks a lot for the many constructive suggestions! Attchached is another response I got directly. Best regards, Mark __ Hello Mark, for low absorbing proteins, the Ehresmann method is a good

[ccp4bb] Thanks! Re: [ccp4bb] Problem on creating a new monomer

2007-05-07 Thread XJ XJ
Thanks for all the quick replies! The problem turned out to be that the Turbo output pdb file of my ligand (created by using the MAKE command) somehow failed to label all my carbon atoms as C. Instead, all my carbons were labelled with just the number. For example, C12 was mislabelled as 12.