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- W2004202306 abstract "The positions of eight Se atoms in a selenomethionyl 35 kDa protein were determined at 2.0 and 2.5 Å resolution using the direct-methods program SnB. Data at the selenium peak, edge and remote wavelengths were measured and processed independently. Anomalous difference E magnitudes at each wavelength were derived by two different procedures: renormalized diffE values were calculated according to the equation diffE = {sum[(f + f')^{2} + f''^{2}]big||E_{+}| − |E_{-}|big|}^{1/2}/2q(sum f''^{2})^{1/2}, where q is a least-squares fitted renormalization function of sinθ/λ such that 〈diffE2〉 = 1.0; and difference E magnitudes were calculated from Delta F^{2}. Locally normalized E magnitudes corresponding to |FA| were also derived from the combination of the data at all three wavelengths through the use of the MADSYS program suite. Each of the independent sets of anomalous difference E magnitudes was capable of producing the correct solution, as did the E data obtained from the FA data. Higher success rates with SnB were observed for the 2.0 Å peak and edge diffE data." @default.
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- W2004202306 date "1998-09-01" @default.
- W2004202306 modified "2023-10-01" @default.
- W2004202306 title "The Use of SnB to Determine an Anomalous Scattering Substructure" @default.
- W2004202306 cites W614374080 @default.
- W2004202306 doi "https://doi.org/10.1107/s0907444997018805" @default.
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