A Research Associate position in protein crystallography is available
within the group of Prof. Paul Freemont (Division of Molecular
Biosciences, Imperial College London: www.imperial.ac.uk/molecularbiosciences)
as part of the Imperial College Small Molecule Cancer Drug Discovery
It is important that your new smaller test set include only reflections
that were in your previous test set, and not include any of the previous
working reflections.
By now you probably have several replies detailing how to achieve this in ccp4.
If you happen to be using CNS, there is an easy
I suspect that in many cases the crystal is making the news instead on
reporting the actual status of bound waters in fluid conditions. One should
probably be looking at NMR structures for a more valid report of bound waters.
Are there any reports of the comparison of the number of bound
On Wed, 18 Jun 2008, Paul Kraft wrote:
Are there any reports of the comparison of the number of bound waters
in crystal structures vs NMR structures? Paul Kraft
this is discussed inter alia in :
Mattos, C. Ringe, D., Solvent Structure, in International Tables for
Crystallography (Rossman,
Title: Re: [ccp4bb] Fw: Re: [ccp4bb] Structural importance of ordered water?
Some work has been done on collagen regardingits hydration structure:
(crystal data) Bella,J.Brodsky, B. Berman, H.M.. Structure (3), 893-906 1995
(NMR) Peto, S. Gillis, P. Henri, V.P.. Biophys J. (57), 71-84, 1990
Dear all,
there are still a few places left in the
EMBO World Lecture Course on
RECENT DEVELOPMENTS IN MACROMOLECULAR CRYSTALLOGRAPHY
which I had announced earlier (see below).
Check out the web page http:/cwp.embo.org/wpc08-02/
or contact me for further information.
The NEW
-Original Message-
From: [EMAIL PROTECTED]
[mailto:[EMAIL PROTECTED] On Behalf Of Sanishvili, Ruslan
Sent: 17 June 2008 22:17
To: Nave, C (Colin); CCP4BB@JISCMAIL.AC.UK
Cc: Richard Gillilan
Subject: RE: [ccp4bb] Structural importance of ordered water?
Surely protein-water
Hi all,
our library sketcher all of a sudden started acting up after working just
fine.
- read in or draw a structure works fine,
- Create library description - a message pops up:
Error running Libcheck program see
/tmp/jabendroth/7547_tmp
Sorry - this means we can not list the monomers in the
