Try fitting a xylitol molecule in it but watch out for the distortions
caused by proximity to symmetry axis.

Artem

On Thu, Mar 31, 2011 at 1:16 PM, Shu XU <xushuh...@gmail.com> wrote:

> Hi, there.
> I'm refining a 1.76 A structure. The r-work stuck at 21%, rfree is 24%
> after adding waters.
> But there is something between the interfaces of the dimers.
> The space group is I4122, so it looks like something small, five or
> six atoms all together (without hydrogens).
> I tried to fit Tris in, however, it didn't look good at all.
> The crystal came out from Tris-cl buffer, ammonium sulfate, and there
> is some NaCl in the protein buffer too.
> The crystals were dropped into 20% xylitol and flash frozen.
> Fo-Fc maps are attached at 3 sigma level.
> Let me know what you're thoughts are.
> Thank you for your help.
>
> Shu
>
>
> --
> Shu Xu
> Ph.D candidate in Chemistry
> Department of Chemistry
> The University of Toledo
> Toledo, OH 43606
> Tel 419-530-1524
>

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