Citations
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Colouring cryo-cooled crystals: online microspectrophotometry
John McGeehan,John McGeehan,Raimond B. G. Ravelli,Raimond B. G. Ravelli,James W. Murray,James W. Murray,Robin L. Owen,Florent Cipriani,Sean McSweeney,Martin Weik,Elspeth F. Garman +10 more
TL;DR: A portable and readily aligned online microspectrophotometer that can be easily installed on macromolecular crystallography beamlines is described, which allows measurement of the spectral characteristics of macromolescular crystals prior, during, and after the X-ray diffraction experiment.
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Sodium carbonate revisited.
TL;DR: Arguments supporting the hypothesis that the driving force of the phase transitions may originate in the unsaturated bonding potential of one of the Na ions are presented.
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2-Bromo-pyridine-3-carboxylic acid.
R. Alan Howie,Raoni S.B. Goncalves,Marcus V. N. de Souza,Edward R. T. Tiekink,James L. Wardell +4 more
TL;DR: The carboxylic acid residue in the title compound, C6H4BrNO2, is twisted out of the plane of the other atoms, as indicated by the (Br)C-C−C−O carbon-carbon-yl torsion angle of −20.1°(9)° as mentioned in this paper.
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The impact of Glu→Ala and Glu→Asp mutations on the crystallization properties of RhoGDI: the structure of RhoGDI at 1.3 Å resolution
Agnieszka Mateja,Yancho Devedjiev,Daniel Krowarsch,Kenton L. Longenecker,Zbigniew Dauter,Jacek Otlewski,Zygmunt S. Derewenda +6 more
TL;DR: The present study strongly supports the notion that rational surface mutagenesis can be an effective tool in overcoming problems stemming from the protein's recalcitrance to crystallization and may also yield dramatic improvements in crystal quality.
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Using prime-and-switch phasing to reduce model bias in molecular replacement
TL;DR: Applications of the technique of prime-and-switch phasing to reduce bias in atomic models and reduce errors in interpretation of electron density in a wide range of applications of macromolecular crystallography are shown.
References
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The Protein Data Bank
Helen M. Berman,John D. Westbrook,Zukang Feng,Gary L. Gilliland,Talapady N. Bhat,Helge Weissig,Ilya N. Shindyalov,Philip E. Bourne +7 more
TL;DR: The goals of the PDB are described, the systems in place for data deposition and access, how to obtain further information and plans for the future development of the resource are described.
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Crystal structure refinement with SHELXL
TL;DR: New features added to the refinement program SHELXL since 2008 are described and explained.
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Coot: model-building tools for molecular graphics.
Paul Emsley,Kevin Cowtan +1 more
TL;DR: CCP4mg is a project that aims to provide a general-purpose tool for structural biologists, providing tools for X-ray structure solution, structure comparison and analysis, and publication-quality graphics.
Journal ArticleDOI
PHENIX: a comprehensive Python-based system for macromolecular structure solution
Paul D. Adams,Paul D. Adams,Pavel V. Afonine,Gábor Bunkóczi,Vincent B. Chen,Ian W. Davis,Nathaniel Echols,Jeffrey J. Headd,Li-Wei Hung,Gary J. Kapral,Ralf W. Grosse-Kunstleve,Airlie J. McCoy,Nigel W. Moriarty,Robert D. Oeffner,Randy J. Read,David S. Richardson,Jane S. Richardson,Thomas C. Terwilliger,Peter H. Zwart +18 more
TL;DR: The PHENIX software for macromolecular structure determination is described and its uses and benefits are described.
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Phaser crystallographic software
Airlie J. McCoy,Ralf W. Grosse-Kunstleve,Paul D. Adams,Martyn Winn,Laurent C. Storoni,Randy J. Read +5 more
TL;DR: A description is given of Phaser-2.1: software for phasing macromolecular crystal structures by molecular replacement and single-wavelength anomalous dispersion phasing.