Dear All,

 

we have updated the ligand structure database distributed with the TWILIGHT
package 

 

http://www.ruppweb.org/twilight/default.htm

 

to include all PDB entries with an EDS entry up to the Jan 16 2013 release.
The table contains now about 500 more flagged entries. As always, the
disclaimer: TWILIGHT employs automatic ranking based on an arbitrarily
selected resolution dependent real space correlation cutoff for ligand
density and does NOT provide any further analysis - please inspect the
density in each case - various causes can lead to a flagged entry (as
explained in the accompanying publications). Editorial, paper, explanation &
caveats:

 

http://journals.iucr.org/d/issues/2013/02/00/issconts.html

http://journals.iucr.org/f/issues/2013/02/00/issconts.html

 

Happy twilighting,  BR   

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Bernhard Rupp 

k.-k. Hofkristallamt

Vista, CA 92084

001 (925) 209-7429

b...@ruppweb.org

b...@hofkristallamt.org

http://www.ruppweb.org/

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