Updated example thaumatin data set from Diamond Light Source VMXi
收藏Zenodo2020-07-17 更新2026-05-25 收录
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Example data set from the VMXi beamline at Diamond Light Source recorded in situ from a thaumatin crystal with processing results:
<pre>For AUTOMATIC/DEFAULT/NATIVE Overall Low High
High resolution limit 1.85 5.02 1.85
Low resolution limit 50.49 50.50 1.88
Completeness 68.0 100.0 2.7
Multiplicity 3.3 3.9 1.0
I/sigma 12.9 24.8 1.4
Rmerge(I) 0.056 0.031 0.386
Rmerge(I+/-) 0.047 0.027 0.000
Rmeas(I) 0.065 0.035 0.545
Rmeas(I+/-) 0.061 0.035 0.000
Rpim(I) 0.032 0.017 0.386
Rpim(I+/-) 0.038 0.022 0.000
CC half 0.998 0.999 0.000
Wilson B factor 20.100
Anomalous completeness 58.0 99.8 0.1
Anomalous multiplicity 1.9 2.4 1.0
Anomalous correlation -0.015 -0.107 0.000
Anomalous slope 0.928
Total observations 53105 5240 32
Total unique 15898 1349 31
Assuming spacegroup: P 41 21 2
Other likely alternatives are:
P 43 21 2
Unit cell (with estimated std devs):
58.6330(3) 58.6330(3) 151.4573(10)
90.0 90.0 90.0
</pre>
提供机构:
Zenodo
创建时间:
2019-01-23



