Re: [ccp4bb] twin fraction varies between crystals?

2007-04-17 Thread Bryan W. Lepore
could anyone share their experience in seeding from a low-twin fraction crystal found in a drop with high twin-fraction crystals? -bryan

Re: [ccp4bb] twin fraction varies between crystals?. .

2007-04-17 Thread Iain Kerr
Mark, I had a very similar problem. Varying twin fraction in identical drops - no logical pattern. I eventually solved the structure as you seem to have, screening dozens of crystals to find an untwinned crystal or at least one with very low or statistically insignificant twin fraction (which

Re: [ccp4bb] twin fraction varies between crystals?

2007-04-17 Thread Manish C Pathak
I agree with you Mark. Even in my case the twinning fractions varied substantially among the different crystals grown in same drop. Moreover, I feel the fractions may vary at different part of the crystal too. Please correct me if i am wrong. regards Manish Mark Mayer <[EMAIL PROTECTED]> wro

Re: [ccp4bb] twin fraction varies between crystals?

2007-04-17 Thread Christopher Colbert
I experienced the same behavior. Crystals from the same drop could have varying twin fractions. Screening for twinning can be done with remarkably few degrees of data. Of course, all proteins and all twins aren't equal. So, don't expect to have varying twin fractions all the time. Happy R

Re: [ccp4bb] twin fraction varies between crystals?

2007-04-17 Thread Peter Zwart
Hi Mark, Estimating twin fractions is best done on the basis of refining it with a model. This can be done with phenix.refine or other programs like shelx or CNS. The ML estimate ofd the twin fraction relies on the correctness of the sigmas. The 0.02 is actually the lower limit the ML proced

[ccp4bb] twin fraction varies between crystals?

2007-04-17 Thread Mark Mayer
For cases where people have had merohedral twinning, did the twin fraction vary substantially between individual crystals grown under indentical conditions? I have no prior experience with merohedral twinning, and was surprised to see that the twin fraction varied substantially as detailed be

[ccp4bb] Research/Senior Associate - Structural Biology

2007-04-17 Thread Sridhar Prasad
Research/Senior Associate - Structural Biology - Metabasis Therapeutics Inc. - San Diego, CA We invite you to join the team of committed and talented scientists to develop novel drug towards metabolic and related diseases. You will have an excellent opportunity to apply the science of protein

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2007-04-17 Thread Kornelius Zeth
you can derivatize the protein before crystallization. By mass you can check the amount as most derviatives bind covalent. Moreover you can remove metal that doesn't bind. Best of luck Kornelius On Tue, 17 Apr 2007 13:49:33 -0400 [EMAIL PROTECTED] wrote: > Hi, > > Without knowing exactly what

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2007-04-17 Thread artem
Hi, Without knowing exactly what you did, it's hard to guess however here are a few suggestions, in addition to the ideas already given by others: a. try iodination. Simply place an iodine crystal near the drop (glue it to the cover slip using a tiny bit of grease) and let the vapors penetrate th

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2007-04-17 Thread Das, Debanu
Hi Daniel, You can also refer to HATODAS, http://hatodas.harima.riken.go.jp/, where you can find suitable heavy atom compounds to use based not only on the sequence of your protein but also the crystallization conditions, as is your case. This is based on the following paper: Heavy-atom Databa

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2007-04-17 Thread Mathews, Irimpan
Hi Daniel, 1. You may try Xenon or Kr pressure cell. We have a simple version of these cells at SSRL (see the link below). Rigaku also has slightly more complex version. Let me know if you want to try this and you don't have access to a pressure cell. http://smb.slac.stanford.edu/public

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2007-04-17 Thread HKim
Hi, Daniel, Have you tried Br? Do a search on Zbyszek Dauter and halide phasing. Good luck, Hidong Daniel Gutmann <[EMAIL PROTECTED]> Sent by: CCP4 bulletin board 04/17/2007 10:03 AM Please respond to Daniel Gutmann <[EMAIL PROTECTED]> To CCP4BB@JISCMAIL.AC.UK cc Subject [ccp4bb

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2007-04-17 Thread Daniel Gutmann
Hey there, I have crystallised a protein in 30% MPD and it it gives nice native data. However, it seems impossible to get heavy metal derivatives and I read that MPD does chelate heavy metals. Did any of you make similar experiences with xtals in MPD conditions? If so did you find a go

[ccp4bb] [CCP4] JOBS Two post doc positions available in North Chicago, IL USA

2007-04-17 Thread Carl Correll
Two NIH funded post doc positions available in North Chicago, IL USA Motivated and creative postdoctoral applicants are sought by the Correll laboratory to study how site-specific chaperones and their assemblies mediate ribosome biogenesis. The studies will exploit our in vitro assays that mimic

[ccp4bb] SCSB Structural Biology Symposium, May 18-19th, Galveston Texas

2007-04-17 Thread Mark A. White
Abstract Submission Deadline has been extended to April 20th. 12th Annual Structural Biology Symposium Sealy Center for Structural Biology UTMB, Galveston, Texas May 18th and 19th, 2007 http://www

Re: [ccp4bb] phosphorylation of protein is troublesome or not for crystallization

2007-04-17 Thread artem
Rongjin, Yes, there most definitely are numerous examples of phosphorylated, glycosylated, lipidilated, etc. etc. proteins crystallized. Since you are asking specifically about phosphorylation here are my two cents: a. over one half of all heterogenously expressed kinases are phosphorylated b. ab

Re: [ccp4bb] bug in pdbset?

2007-04-17 Thread Phil Evans
I don't think you meant to do this. "polar 45 45 0" means no rotation: the 3rd value is the rotation around the axis defined by the first two angles. If you rotate by 0 degrees, it doesn't matter which axis you don't rotate around. Phil pdbset xyzin test-0_2fold.pdb \ xyzout temp

[ccp4bb] bug in pdbset?

2007-04-17 Thread Juergen J. Mueller
Dear developers, trying to get some test coordinate sets with pdbset (suse linux 10.1,ccp4-6.0.2,PDBSET version 6.0: 17/10/06) the option rotate polar does not give the correct values. May be that is due to the special case of coordinates positioned at a circle around the z-axis (see attachements)

[ccp4bb] sumary:number of residues for converting intensities to sf for a protein/DNA complex

2007-04-17 Thread Raymond Yengo
Thank you all for your helpful contributions. Here is a sumary of the sugestions offered. 1)Not very critical, but could consider a nucleic acid to have about twice the size of a typical aminiacid. 2)Just an estimate is needed. Could simply calculate 3 residues per base or 6 per base pair. amino

[ccp4bb] Differentiating bound Mn & Ca - Summary

2007-04-17 Thread David Briggs
Dear all. Thanks to all of those who replied to my question, especially Clemens Vonrhein, who patiently helped me get SHARP up and running... Basically, there were 4 different ways suggested, with a few embellishments here and there. 1) Use Dano peak height. Taking the Dano peak height for intr