Re: [ccp4bb] AW: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement

2020-07-30 Thread Robert Nicholls
Auftrag von Tom Burnley - > UKRI STFC > Gesendet: Mittwoch, 29. Juli 2020 18:51 > An: CCP4BB@JISCMAIL.AC.UK > Betreff: Re: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement > > EXTERNAL : Real sender is owner-ccp...@jiscmail.ac.uk > > > > Hi Herman

[ccp4bb] AW: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement

2020-07-30 Thread Schreuder, Herman /DE
: 30 July 2020 13:28:00 To: ccp4bb Subject: [ccp4bb] AW: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement Hi everybody, Thank you very much for the many tips! I discovered that in Coot by clicking on the N- and C-terminus of a protein chain, one can indeed run a real-space

Re: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement

2020-07-30 Thread Tom Burnley - UKRI STFC
Nachricht- Von: CCP4 bulletin board Im Auftrag von Tom Burnley - UKRI STFC Gesendet: Mittwoch, 29. Juli 2020 18:51 An: CCP4BB@JISCMAIL.AC.UK Betreff: Re: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement EXTERNAL : Real sender is owner-ccp...@jiscmail.ac.uk Hi Herman, The

[ccp4bb] AW: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement

2020-07-30 Thread Schreuder, Herman /DE
etin board Im Auftrag von Tom Burnley - UKRI STFC Gesendet: Mittwoch, 29. Juli 2020 18:51 An: CCP4BB@JISCMAIL.AC.UK Betreff: Re: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement EXTERNAL : Real sender is owner-ccp...@jiscmail.ac.uk Hi Herman, There is lots of information o

Re: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement

2020-07-29 Thread Guillaume Gaullier
Hello, Have you tried ISOLDE? Interactive MDFF is really powerful both for fixing models with poor geometry and for improving fit to the map. There is a good tutorial for refinement of a model against a cryoEM map with ISOLDE:

Re: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement

2020-07-29 Thread Tom Burnley - UKRI STFC
(and runs Refmac via CCP4). All the best, Tom From: CCP4 bulletin board on behalf of Boaz Shaanan Sent: 29 July 2020 16:31:46 To: ccp4bb Subject: Re: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement Hi, Try searching ccp-em. Boaz Boaz Shaanan

Re: [ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement

2020-07-29 Thread Boaz Shaanan
Hi, Try searching ccp-em. Boaz Boaz Shaanan, Ph.D. Department of Life Sciences Ben Gurion University of the Negev Beer Sheva Israel On Jul 29, 2020 18:29, "Schreuder, Herman /DE" wrote: Coot does it, but if one wants to do it for a complete protein, it is a lot of clicking. On the

[ccp4bb] AW: [EXTERNAL] Re: [ccp4bb] real real-space-refinement

2020-07-29 Thread Schreuder, Herman /DE
Coot does it, but if one wants to do it for a complete protein, it is a lot of clicking. On the other hand, I have not tried to just select the N- and C-terminus for real-space refinement to see what happens. I would prefer to have some script to do it. Best, Herman Von: Eleanor Dodson