Properties of an electron-density map derived from a limited number of experimentally determined triplet phases

Citation
K. Holzer et al., Properties of an electron-density map derived from a limited number of experimentally determined triplet phases, ACT CRYST D, 56, 2000, pp. 322-327
Citations number
19
Categorie Soggetti
Chemistry & Analysis
Journal title
ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY
ISSN journal
09074449 → ACNP
Volume
56
Year of publication
2000
Part
3
Pages
322 - 327
Database
ISI
SICI code
0907-4449(200003)56:<322:POAEMD>2.0.ZU;2-8
Abstract
In a previous communication [Weckert et al. (1999). Acta Cryst. D55, 1320-1 328], the feasibility of the measurement of a large set of triplet phases b y three-beam interference was demonstrated. This paper reports the methodol ogy for the calculation of an electron-density map from this limited amount of experimental phase information and the map's properties with respect to model, building and refinement. The tetragonal form of hen egg-white lysoz yme (HEWL) was chosen as a test structure for the development of this metho d, The quality of the electron-density map obtained from all measured tripl et phases allows a straightforward and nearly complete interpretation. The starting model was refined to a final R Value of 17.4%. In a second step, t he minimum number of phased reflections needed for the interpretation of an electron-density map was investigated, applying criteria based on \F\ and resolution.