SOLVE and RESOLVE: automated structure solution, density modification and model building.

Thomas Terwilliger

doi:10.1107/s0909049503023938

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SOLVE and RESOLVE: automated structure solution, density modification and model building.

Thomas Terwilliger

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Abstract

The software SOLVE and RESOLVE can carry out all the steps in macromolecular structure solution, from scaling and heavy-atom location through phasing, density modification and model-building in the MAD, SAD and MIR cases. SOLVE uses scoring scheme to convert the decision-making in macromolecular structure solution to an optimization problem. RESOLVE carries out the identification of NCS, density modification and automated model-building. The procedure is fully automated and can function at resolutions as low as 3 A.

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Algorithms Binding Sites Computer Simulation Crystallography Databases, Protein Macromolecular Substances Models, Molecular Protein Binding Protein Conformation Proteins Sequence Analysis, Protein Software User-Computer Interface Journal Article Research Support, U.S. Gov't, P.H.S.

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Thomas Terwilliger. 2003-11-28. SOLVE and RESOLVE: automated structure solution, density modification and model building.. https://doi.org/10.1107/s0909049503023938

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