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SSX: Difference between revisions
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This article deals with how to process serial synchrotron crystallography (SSX) data. These particular data are artificial and were obtained from James Holton’s microfocus challenge page | |||
http://bl831.als.lbl.gov/~jamesh/challenge/microfocus/; the raw data were downloaded from http://bl831.als.lbl.gov/example_data_sets/tarballs/Illuin_microfocus_minimal_00[1-3].tar.bz2 . | |||
The challenges are | |||
# strong radiation damage | |||
# the b and c axes are the same length, but the crystals are orthorhombic. This makes it difficult to index them consistently - it is easy (and wrong) to just merge them, and obtain a pseudo-tetragonal merged data set. | |||
== Round 1: processing the data, and determining the space group == | == Round 1: processing the data, and determining the space group == | ||
Using the following as the processing script integrate.rc: | Using the following as the processing script integrate.rc: | ||