Citations
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Seeding for sirtuins: microseed matrix seeding to obtain crystals of human Sirt3 and Sirt2 suitable for soaking.
TL;DR: In the present study, microseed matrix seeding was successfully applied to obtain a large number of crystals of the human sirtuin isotypes Sirt2 and Sirt3 that were subsequently used to study the protein–ligand interactions of two indole inhibitors.
Journal ArticleDOI
Recognition of RNase Sa by the inhibitor barstar: structure of the complex at 1.7 A resolution.
TL;DR: The structure of RNase Sa complexed with the polypeptide inhibitor barstar is reported, the first structure which includes wild-type barstar, providing an explanation of the reduced binding affinity in the former.
Journal ArticleDOI
Structure of the unbound form of HIV-1 subtype A protease: comparison with unbound forms of proteases from other HIV subtypes.
Arthur H. Robbins,Roxana M. Coman,Edith Rosvely Bracho-Sanchez,Marty A. Fernandez,C. Taylor Gilliland,Mi Li,Mavis Agbandje-McKenna,Alexander Wlodawer,Ben M. Dunn,Robert McKenna +9 more
TL;DR: The crystal structure of the unbound form of HIV-1 subtype A protease (PR) has been determined to 1.7 A resolution and refined as a homodimer in the hexagonal space group P6(1) to an R(cryst) of 20.5%.
Journal ArticleDOI
X-ray Crystallography of Surfaces and Interfaces
TL;DR: X-ray crystallographic studies of surface structure have a much shorter history than the IUCr (and crystallography in general) because it is a technique that requires very intense sources of X-rays as mentioned in this paper.
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Mapping the synthesis of low nuclearity polyoxometalates from octamolybdates to Mn-Anderson clusters.
TL;DR: This is the first example where symmetric organically-grafted Mn-Anderson compounds have been synthesised in DMF from anything but the {Mo(8)O(26)} α-isomer.
References
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Journal ArticleDOI
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.
Journal ArticleDOI
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.
Journal ArticleDOI
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.