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Molecular replacement and high-throughput structure determination
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J. Navaza
Published/Copyright:
September 25, 2009
Abstract
We describe the philosophy of the MR method as implemented in the AMoRe package. Fast rotation and translation functions are first used to obtain a meaningful sampling of solution space, whose elements are subsequently assessed by using more robust criteria. The introduction of fast and accurate algorithms for screening a large number of possible solutions opened the way to automation, thus bringing MR methods to the realm of high-throughput structure determination. Selected examples are discussed to illustrate specific aspects of the method.
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Published Online: 2009-9-25
Published in Print: 2002-12-1
© 2002 Oldenbourg Wissenschaftsverlag GmbH
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Articles in the same Issue
- Preface: Macromolecular Crystallography
- More power for direct methods: SIR2002
- ACORN — theory and practice
- Macromolecular phasing with SHELXE
- Physical measurement of triplet invariants: present state of the experiment, data evaluation and future perspectives
- Qantitative determination of phase for macromolecular crystals using multiple diffraction methods and dynamical theory
- Ab initio phasing starting from low resolution
- Towards automated protein structure determination: BnP, the SnB-PHASES interface
- Direct way to anomalous scatterers
- The approach of the joint probability distribution functions: the SIR-MIR, SAD-MAD and SIRAS-MIRAS, cases
- Direct-method phasing of anomalous diffraction from proteins
- Molecular replacement and high-throughput structure determination
