1RQW: Difference between revisions

144 bytes added ,  1 May 2008
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=== automatic structure solution using Auto-Rickshaw (http://www.embl-hamburg.de/Auto-Rickshaw/) ===
=== automatic structure solution using Auto-Rickshaw (http://www.embl-hamburg.de/Auto-Rickshaw/) ===


In the same way as with the peak data, Auto-Rickshaw was started. The structure could be solved but the process was laborious - take a look at the [[1rqw_arp_warp_log|Arp/Warp logfile]]!
In the same way as with the peak data, Auto-Rickshaw was started. The structure could be solved but the process was laborious - take a look at the [[1rqw_arp_warp_log|Arp/Warp logfile]]! The final model lacks residues 1, 85, 205, 206, 207 and the "core RMS" of SSM superpose, against 1rqw, is 0.15 Å (better than I would expect).


It should be noted that the structure can ''not'' be solved when searching for 15 or 28 sites - rather, 20 appears to be the magic number.
It should be noted that the structure can ''not'' be solved when searching for 15 or 28 sites - rather, 20 appears to be the magic number.


Once again, great job, Santosh (and of course those people who wrote the programs that Auto-Rickshaw uses)!
Once again, great job, Santosh (and of course those people who wrote the programs that Auto-Rickshaw uses)!
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