Low-resolution phase extension using wavelet analysis

Authors
Citation
P. Main et J. Wilson, Low-resolution phase extension using wavelet analysis, ACT CRYST D, 56, 2000, pp. 1324-1331
Citations number
12
Categorie Soggetti
Chemistry & Analysis
Journal title
ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY
ISSN journal
09074449 → ACNP
Volume
56
Year of publication
2000
Part
10
Pages
1324 - 1331
Database
ISI
SICI code
0907-4449(200010)56:<1324:LPEUWA>2.0.ZU;2-9
Abstract
A method to extend low-resolution phases is presented which uses histogram matching not only of the electron density, but also of histograms obtained from the different levels of detail provided by the wavelet transform of th e electron density. Statistical values for the wavelet coefficients can be predicted and depend only on the resolution and solvent content. Therefore, new details can be added to an electron-density map by matching the values of the wavelet coefficients to those predicted for an increased resolution . The positions of the new details are also guided by the diffraction patte rn. In this way, the resolution can be increased gradually; on a number of trial structures of different size, solvent percentage and space group, it has been possible to extend the phasing from 10 Angstrom to around 6-7 Angs trom.