Just checking my oxidized Se-Met experiments, I have 12658 to 12661 eV for my peak energies, and 3 eV lower for the inflection. As others have said, do the fluorescence scan. Use your experimentally determined values.

Engin

On 7/16/09 11:54 AM, Phil Jeffrey wrote:
Always take the scan results ahead of the typical values unless they are obviously wrong. Only use the "predicted" values if the scan is broken or too weak (e.g. very small crystals) and in that case I'd be tempted to add 10-20 eV to the "typical" peak wavelength to make sure you weren't actually collecting the inflection point since they are typically very close in SeMet.

In my NSLS X29-dominated data collections, I find I end up using something like this for non-oxidized SeMet:

Peak: 12664 eV, 0.9790 Angstrom   (usually in range 12662-12664)
Infl: 12662 eV, 0.9792 Angstrom   (usually in range 12660-12662)
I also typically use high energy remote: 12860 eV, 0.964 Angstrom

give or take a few eV. This tends to translate well between the relatively small number of beamlines that I personally end up using. But I always prefer to take the results from the Chooch analysis of the scan from the actual crystal.

Cheers (and good luck)
Phil Jeffrey
Princeton


Jerry McCully wrote:
Dear All:

     Next week we are going to try some seleno-Met labeled crystals.

We checked the literature to try to find out the peak wavelength that has been used for SAD or MAD data collection. But they are slightly different ( may be 50 ev) in different papers.

I guess this is due to the discrepancy between the fluorescence scanning and the theoretical vaules of f' and f''.

When we collect the data, which wavelength should we use? Should we trust the scanning results?


--
Engin Özkan
Post-doctoral Scholar
Laboratory of K. Christopher Garcia
Howard Hughes Medical Institute
Dept of Molecular and Cellular Physiology
279 Campus Drive, Beckman Center B173
Stanford School of Medicine
Stanford, CA 94305
ph: (650)-498-7111

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