Dear Jacob, 

You may find useful this web site by Marjorie Harding about metal coordination 
sites in proteins
http://tanna.bch.ed.ac.uk/

best regards


Stefano Benini, Ph.D.
Assistant Professor

http://pro.unibz.it/staff2/sbenini/

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Bio-organic Chemistry Laboratory
Faculty of Science and Technology
Free University of Bolzano
Piazza Università, 5
39100 Bolzano, Italy
Office (room K2.14):  +39 0471 017128
Laboratory (room E.012): +39 0471 017901
Fax: +39 0471 017009
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-----Original Message-----
From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of Jacob 
Keller
Sent: Wednesday, 16 November, 2011 19:21
To: CCP4BB@JISCMAIL.AC.UK
Subject: [ccp4bb] Distinguish NH4 from Na?

Dear Crystallographers,

I have crystals containing 666mM NH4 and 540mM Na, and there appears
to be a "water" which is only about 2.2 Ang from some polar atoms. It
is currently reasonably happy as a Na, but is there any reasonable way
to decide which cation is there?

JPK

-- 
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Jacob Pearson Keller
Northwestern University
Medical Scientist Training Program
email: j-kell...@northwestern.edu
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