IMPROVING DIRECT-METHODS PHASES BY HEAVY-ATOM INFORMATION AND SOLVENTFLATTENING

Citation
C. Giacovazzo et D. Siliqi, IMPROVING DIRECT-METHODS PHASES BY HEAVY-ATOM INFORMATION AND SOLVENTFLATTENING, Acta crystallographica. Section A, Foundations of crystallography, 53, 1997, pp. 789-798
Citations number
31
Categorie Soggetti
Crystallography
ISSN journal
01087673
Volume
53
Year of publication
1997
Part
6
Pages
789 - 798
Database
ISI
SICI code
0108-7673(1997)53:<789:IDPBHI>2.0.ZU;2-P
Abstract
In a recent series of papers, a procedure has been described for phasi ng all the reflections up to derivative resolution by using triplet ph ase relationships [Giacovazzo, Cascarano & Zheng (1988). Acta Cryst. A 44, 45-51]. The resulting electron-density maps show good correlation with the correct maps but usually are not straightforwardly interpreta ble. In this paper, the quality of the phases is improved by: (a) expl oiting the information on the heavy-atom structure, which becomes avai lable as soon as protein phases are available; (b) applying a suitable solvent-flattening procedure (FLEX), which proves highly effective in reducing the phase error.