hey Mischa
I would guess that is a split cobalt/metal site occupancy 0.1 and 0.9 or 
something like that.  
If you calculate an anomalous difference map you may be able to confirm/reject 
that suggestion, depending on the strength of the anomalous signal.

cheers
Preben  
 
On 07.07.2011, at 17:07, Machius, Mischa Christian wrote:

> Y'all,
> 
> I was wondering if anyone had any thoughts about a feature we observe with a 
> metal-binding site: we have a cobalt that is bound by four histidines and one 
> carboxyl group. There is extra density near the cobalt. See pictures below. 
> The extra density spans the NE2 atoms from two histidines. The Fo-Fc peak 
> (green) has a height of up to 10 sigma (eight molecules in the asymmetric 
> unit, all showing the same feature).
> 
> I placed a water molecule into the density to get some distances: the 
> distances between the peak and the neighboring histidine NE2 atoms is ~1.8Å 
> and ~2.0Å, resp. The distance between the peak and the cobalt is ~1.7Å. The 
> resolution is 1.24Å.
> 
> Any input would be greatly appreciated.
> 
> Many thanks in advance!
> 
> Cheers!
> MM
> 
> 
> <Screen shot 2011-07-07 at 9.44.43 AM.png><ATT00001.c><Screen shot 2011-07-07 
> at 9.44.55 AM.png>

J. Preben Morth, Ph.D
Group Leader
Membrane Transport Group
Nordic EMBL Partnership
Centre for Molecular Medicine Norway (NCMM)
University of Oslo
P.O.Box 1137 Blindern
0318 Oslo, Norway

Email: [email protected]
Tel: +47 2284 0794

http://www.jpmorth.dk

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