Beyond the crystallization paradigm: structure determination from diffraction patterns from ensembles of randomly oriented particles

Ultramicroscopy. 2011 Jun;111(7):798-806. doi: 10.1016/j.ultramic.2010.11.003. Epub 2010 Dec 1.

Abstract

We amplify on the principles of the method we have recently proposed for recovering an oversampled diffraction pattern of a single particle from measured diffraction patterns from multiple particles in orientations related by rotation about an axis parallel to the incident radiation. We propose an alternative method of phasing a reference resolution ring by means of a non-negativity constraint on the diffraction intensities, point out the need for caution about enantiomeric ambiguities in the reconstruction of a diffraction pattern from its angular correlations, and show that converged correlations may be deduced by appropriate averaging of even very noisy data.

Publication types

  • Research Support, U.S. Gov't, Non-P.H.S.

MeSH terms

  • Algorithms
  • Crystallization / methods*
  • Electrons*
  • Image Processing, Computer-Assisted
  • Radiation Dosage
  • X-Ray Diffraction / methods*