You can use the "hkl matrix" keyword in scalepack to do this, either on the .x files or at a push on the .sca file. See the hkl research website to look at the manual for details.
Are you sure this reindexing does not have a negative matrix? Johan Dr. Johan P. Turkenburg X-ray facilities manager York Structural Biology Laboratory University of York Phone (+) 44 1904 328251 York YO10 5DD UK Fax (+) 44 1904 328266 2010/1/13 Francis E Reyes <francis.re...@colorado.edu>: > Hi all > > I have data integrated and scaled to P21 via denzo/scalepack. I'm concerned > about > the workflow to obtain the alternate indexing arrangement (h,k,l) -> > (h,-k,-h-l). > > I was thinking .sca ( not specifying NO MERGE) -> .mtz -> reindex but the > documentation for reindex says all my DANO columns are 'negated' ( I do not > specify NOREDUCE). So I must run truncate on the reindexed intensities to > recalculate F(+/-) and DANO/SIGDANO) ? > > Thanks > > FR >
