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I couldn’t agree more with Patrick which is often the case.

To echo some of his comments, in the High-Throughput Crystallization Screening Center we see many examples where the visual images of initial crystallization hits are very poor and experienced (or inexperienced) crystallographers would typically ignore them. SONICC and UV two photon fluorescence images can indicate something far more promising. Optimization of the visually ‘crappy’ crystals (or even things that really don’t look like crystals to the eye) that have strong SONICC or UV two photon fluorescence very often produces beautiful results. We published a short paper on this  “The detection and subsequent volume optimization of biological nanocrystals, Luft JR, et al.. Struct Dyn. 2015 May 15;2(4):041710 and have seen many examples since. The crystallization research page of the High-Throughput Screening Center (http://getacrystal.org) has a link to this paper under the Crystallization Research section and there is a more extensive literature related to this research are on the website in my signature.

Excuse the shameless plug, but if you don’t have SONICC and UV-two photon detection, this is a standard part of the crystallization screening center available to all and run by Dr. Sarah Bowman (https://hwi.buffalo.edu/scientist-directory/sbowman/) – Details at http://getacrystal.org. There is also some news on automated outcome classification just to put a teaser of things to come out there.

Best,

Eddie

Edward Snell Ph.D.

Biological Small Angle Scattering Theory and Practice, Eaton E. Lattman, Thomas D. Grant, and Edward H. Snell.
Available through all good bookshops, or direct from Oxford University Press

Director of the NSF BioXFEL Science and Technology Center
President and CEO Hauptman-Woodward Medical Research Institute
BioInnovations Chaired Professorship, University at Buffalo, SUNY
700 Ellicott Street, Buffalo, NY 14203-1102
hwi.buffalo.edu
Phone:       (716) 898 8631         Fax: (716) 898 8660
Skype:        eddie.snell                 Email: [log in to unmask]
Webpage: https://hwi.buffalo.edu/scientist-directory/snell/

[cid:image001.png@01D4150E.CF9BD9D0]
Heisenberg was probably here!

From: CCP4 bulletin board [mailto:[log in to unmask]] On Behalf Of Patrick Shaw Stewart
Sent: Friday, July 6, 2018 7:08 AM
To: [log in to unmask]
Subject: Re: [ccp4bb] Please share your experience about "ugly" crystals showing good diffraction


Hi All

I have a comment, based on my old supervisor's explanation, which seemed to make sense.

Crystals usually grow layer by layer.  Once a new layer is formed it quickly expands to cover the whole surface.  That's why crystals normally have flat surfaces and sharp edges - the layers/steps expand rapidly until they get to the edges.

However it doesn't have to be like that.  Sometimes new layers can form roughly as quickly as the previous layers can spread.  The result is crystals with curved surfaces - or even just blobs.

Just because the new layers form at a rate that is comparable to the spreading doesn't mean that the crystals won't be ordered, and won't diffract well.

Once I understood that I understood what I was seeing better when I checked my drops.

Best wishes Patrick


On 5 July 2018 at 22:06, Sanishvili, Ruslan <[log in to unmask]<mailto:[log in to unmask]>> wrote:

Hi Anirban,

It would be great if you could share the compilation of relevant responses to your request. I think many others in the community could use these examples for educational purposes.

Best,

Nukri


Ruslan Sanishvili (Nukri), Ph.D.
Macromolecular Crystallographer
GM/CA@APS
X-ray Science Division, ANL
9700 S. Cass Ave.
Lemont, IL 60439

Tel: (630)252-0665
Fax: (630)252-0667
[log in to unmask]<mailto:[log in to unmask]>

________________________________
From: CCP4 bulletin board <[log in to unmask]<mailto:[log in to unmask]>> on behalf of Anirban Banerjee <[log in to unmask]<mailto:[log in to unmask]>>
Sent: Thursday, June 28, 2018 7:07 PM
To: [log in to unmask]<mailto:[log in to unmask]>
Subject: [ccp4bb] Please share your experience about "ugly" crystals showing good diffraction


Dear all,

Apologies for the non-CCP4 related question.

If you have concrete experience about visually unappealing, i.e. ugly crystals ( your own take on ugly is fine)  diffracting better than comparably similar sized nicer looking crystals of the same protein, will you please share here ? Even better if that led to a published structure. Might you also have pictures ?

We have all heard anecdotes about not using visual appearance to judge the quality of crystals as far as their ability to give good diffraction data is concerned but I am trying to gather some concrete pointers here to motivate trainees.

Thanks very much for any help.

Best,

Anirban

P.S. I know that there is probably a lot of thought and wisdom  on this this specific topic but I am really looking for actual experience.

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