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Hi Todd,<br>
<br>
Are you sure this is not cubic? You could run xtriage and find out
relatively easely.<br>
<br>
I suggest you give phenix.xmanip a try for reindexing or try to use the
following one-liner:<br>
<br>
iotbx.reflection_file_converter data.sca
--change-of-basis=to_niggli_cell --sca=niggli.sca<br>
<br>
Cheers<br>
<br>
Peter<br>
<br>
<br>
<br>
Green, Todd wrote:
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<p><font size="2">Hello all,<br>
<br>
I have what i believe to be a rhombohedral crystal that has an insanely
large cell with the hexagonal setting:<br>
<br>
533.026 533.026 652.887 90.000 90.000 120.000<br>
<br>
and a modestly large cell comparatively with the rhombohedral setting:<br>
<br>
377 377 377 90 90 90<br>
<br>
I should be able to easily reindex to the smaller cell in scalepack but
for some reason i'm not getting it to work correctly. Rather than
struggle further on a friday afternoon, i figured that i'd give a
phenix app a try. i assume xtriage can do this, can someone point me in
the correct direction?<br>
<br>
thanks in advance-<br>
Todd<br>
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