Figure 2
Strategy for data assembly. Firstly, the indexing and integration of single-crystal data sets are performed as cumulative wedges to find the maximum I/σ(I). Unit-cell variation analysis is used to obtain compatible crystals for a merged reference data set. Secondly, a refined selection of single-crystal data sets is based on the maximum RCC, where RCC is defined as the relative correlation coefficient of a single-crystal data set with the reference data set. Thirdly, iterative crystal and frame rejections are performed to obtain the final scaled and merged data for further analyses. |