Dear All,
thank you all for your suggestions and support. The quick look (by
removing interacting AA and subsequent refinement with and without
little SA) revealed that some AAs are mislocated and indeed seem to be
more directed to the density belonging to the ligand. So, I will try
"some" of your sugestions to intervene bias directly after MR before
further refinement. Thank you again!
Regards,
Aleks
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Aleksandar Bijelic, MSc.
Institut für Biophysikalische Chemie
Universität Wien
Althanstrasse 14
A-1090 Wien
Tel: +43 1 4277 52536
e-Mail: aleksandar.bije...@univie.ac.at
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