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About the σA estimate.

Authors :
Burla MC
Giacovazzo C
Mazzone A
Polidori G
Siliqi D
Source :
Acta crystallographica. Section A, Foundations of crystallography [Acta Crystallogr A] 2011 May; Vol. 67 (Pt 3), pp. 276-83. Date of Electronic Publication: 2011 Mar 30.
Publication Year :
2011

Abstract

The resolution parameter σ(A) is currently used for evaluating the degree of similarity between a model and the target structure. Here, quasi-Wilson distributions are used to represent the local statistics of the normalized amplitudes both for the target and for the model structure. The study uses the joint probability distribution approach to provide (i) a description of the statistical properties of the σ(A) parameter; (ii) a deeper insight into the role, for the σ(A) estimate, of the high-order moments of the target and of the model structure-factor distributions; and (iii) new statistical formulas for estimating σ(A). The theoretical results have been checked using test proteins.

Details

Language :
English
ISSN :
1600-5724
Volume :
67
Issue :
Pt 3
Database :
MEDLINE
Journal :
Acta crystallographica. Section A, Foundations of crystallography
Publication Type :
Academic Journal
Accession number :
21487186
Full Text :
https://doi.org/10.1107/S0108767311007367