3D homology structure model for a pyrazinamide susceptibility test inMycobacterium tuberculosis

Abstract

enantiomorphous shapes. In the case of infinite series the possible solutions may not be enantiomorphous. An example of two different pyramidal bodies is considered. Another type of ambiguity is associated with numerical instability of solution. The dependence of solution dispersion from the maximum scattering angle is considered. Several numerical examples which demonstrate an optimum data angular range existence are given. The main conclusion that prior to experimental data interpretation one should to perform modelling of the expected structure to estimate the degree of ambiguity and to choose both data weighting functions and angular range is shown by the results of model calculations.