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SAD or MAD phasing: location of the anomalous scatterers
Maria Cristina Burla1, Benedetta Carrozzini, Giovanni Luca Cascarano
1Dipartimento di Scienza della Terra, Piazza Università, Perugia, Italy.
Abstract:
The method of joint probability distribution functions is applied in order to estimate the structure-factor moduli of the anomalous scatterer substructure both in the SAD (single-wavelength anomalous dispersion) and in the MAD (multi-wavelength anomalous dispersion) cases. The experimental data |F(1)(+)|, |F(1)(-)|, ..., |F(n)(+)|, |F(n)(-)| measured at n wavelengths are used simultaneously to estimate the value of |F(oa)| arising from the normal scattering of the anomalous scatterers. A practical procedure is described that, when applied to the experimental diffraction data of several proteins, shows robustness and efficiency.