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Figure 2
(a)–(c) Leverage analysis for alanine as a function of |Fo|, |Fo|/σ(|Fo|) and sinθ/λ, respectively. (d) Values of signed T values for the extinction parameter plotted against |Fo|. (e), (f) Sums of T2 values plotted against sinθ/λ for, respectively, fractional coordinates and non-H-atom ADPs for simulated data. The columns of points on the far left of the plots correspond to the restraints.

Journal logoJOURNAL OF
APPLIED
CRYSTALLOGRAPHY
ISSN: 1600-5767
Volume 45| Part 3| May 2012| Pages 417-429
doi:10.1107/S0021889812015191
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