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Atomic resolution applications
International Tables for Crystallography (2012). Vol. F, Section 9.1.13.6, p. 228 [ doi:10.1107/97809553602060000824 ]
Atomic resolution applications 9.1.13.6. Atomic resolution applications As for MAD data, the needs for atomic resolution data are extreme, but rather different in nature. Atomic resolution refinement is addressed in Chapter 18.4 . Suffice it to say that by atomic resolution it is meant that meaningful experimental data extend close to ...
[more results from section 9.1.13 in volume F]
Correcting data for the effects of radiation damage
International Tables for Crystallography (2012). Vol. F, Section 9.1.12.4, p. 226 [ doi:10.1107/97809553602060000824 ]
... allow for the effect of specific structural damage (e.g. the S-S bridges and carboxylic groups) on individual reflection intensities. A method ... phases by SHARP (Schiltz et al., 2004). References Diederichs, K., McSweeney, S. & Ravelli, R. B. G. (2003). Zero- ...
[more results from section 9.1.12 in volume F]
R factor, I/[sigma](I) ratio and estimated uncertainties
International Tables for Crystallography (2012). Vol. F, Section 9.1.11.4, pp. 224-225 [ doi:10.1107/97809553602060000824 ]
... about protein structure precision. Erratum. Acta Cryst. D55, 1108. Diederichs, K. & Karplus, P. A. (1997). Improved R-factor for diffraction ... history of SHELX. Acta Cryst. A64, 112-122. Weiss, M. S. (2001). Global indicators of X-ray data quality. J. ...
[more results from section 9.1.11 in volume F]
Lysozyme as an example
International Tables for Crystallography (2012). Vol. F, Section 9.1.10, pp. 222-223 [ doi:10.1107/97809553602060000824 ]
Lysozyme as an example 9.1.10. Lysozyme as an example Tetragonal hen egg-white lysozyme (Chapter 25.1 and Blake et al., 1967), crystallizing in the space group with cell dimensions a = b = 78.6 and c = 37.2Å, is used here as a model system to illustrate some of the points made above, based ...
Wavelength
International Tables for Crystallography (2012). Vol. F, Section 9.1.9, p. 222 [ doi:10.1107/97809553602060000824 ]
Wavelength 9.1.9. Wavelength The wavelength of X-radiation can be tuned only at synchrotron sources. Rotating-anode generators produce radiation at a fixed wavelength which is characteristic of the metal of the anode, usually copper with [lambda] = 1.542Å. The proper selection of the wavelength is most important for collecting data ...
Crystal-to-detector distance
International Tables for Crystallography (2012). Vol. F, Section 9.1.8, pp. 221-222 [ doi:10.1107/97809553602060000824 ]
Crystal-to-detector distance 9.1.8. Crystal-to-detector distance The crystal-to-detector distance (CTDD) should be selected so that the whole area of the detector is usefully exploited. The shorter the CTDD, the higher the resolution of the indexed reflections at the edge of the image; but if the CTDD ...
Alternative indexing
International Tables for Crystallography (2012). Vol. F, Section 9.1.7.4, p. 221 [ doi:10.1107/97809553602060000824 ]
Alternative indexing 9.1.7.4. Alternative indexing If the crystal point-group symmetry is lower than the symmetry of its Bravais lattice, then the reflections can be indexed in more than one way. In other words, the symmetry of the reflection positions is higher than the symmetry of the distribution of their intensities. ...
[more results from section 9.1.7 in volume F]
Wide slicing
International Tables for Crystallography (2012). Vol. F, Section 9.1.6.7, pp. 215-217 [ doi:10.1107/97809553602060000824 ]
Wide slicing 9.1.6.7. Wide slicing The object of the wide-slicing approach is to acquire the data on as small a number of individual exposures as possible. It involves large [Delta][varphi] values per image, usually of the order of 0.5° or more, which exceed the angular spread. Each image contains ...
[more results from section 9.1.6 in volume F]
The screenless rotation method and 2D detectors
International Tables for Crystallography (2012). Vol. F, Section 9.1.5.2, pp. 212-213 [ doi:10.1107/97809553602060000824 ]
... PILATUS 1M detector. J. Synchrotron Rad. 13, 120-130. Gruner, S. M. & Ealick, S. E. (1995). Charge coupled device X-ray detectors for ...
[more results from section 9.1.5 in volume F]
Synchrotron storage rings
International Tables for Crystallography (2012). Vol. F, Section 9.1.4.2, p. 212 [ doi:10.1107/97809553602060000824 ]
... crystallography. Trends Biochem. Sci. 25, 637-643. Rosenbaum, G., Holmes, K. C. & Witz, J. (1971). Synchrotron radiation as a source ...
[more results from section 9.1.4 in volume F]
International Tables for Crystallography (2012). Vol. F, Section 9.1.13.6, p. 228 [ doi:10.1107/97809553602060000824 ]
Atomic resolution applications 9.1.13.6. Atomic resolution applications As for MAD data, the needs for atomic resolution data are extreme, but rather different in nature. Atomic resolution refinement is addressed in Chapter 18.4 . Suffice it to say that by atomic resolution it is meant that meaningful experimental data extend close to ...
[more results from section 9.1.13 in volume F]
Correcting data for the effects of radiation damage
International Tables for Crystallography (2012). Vol. F, Section 9.1.12.4, p. 226 [ doi:10.1107/97809553602060000824 ]
... allow for the effect of specific structural damage (e.g. the S-S bridges and carboxylic groups) on individual reflection intensities. A method ... phases by SHARP (Schiltz et al., 2004). References Diederichs, K., McSweeney, S. & Ravelli, R. B. G. (2003). Zero- ...
[more results from section 9.1.12 in volume F]
R factor, I/[sigma](I) ratio and estimated uncertainties
International Tables for Crystallography (2012). Vol. F, Section 9.1.11.4, pp. 224-225 [ doi:10.1107/97809553602060000824 ]
... about protein structure precision. Erratum. Acta Cryst. D55, 1108. Diederichs, K. & Karplus, P. A. (1997). Improved R-factor for diffraction ... history of SHELX. Acta Cryst. A64, 112-122. Weiss, M. S. (2001). Global indicators of X-ray data quality. J. ...
[more results from section 9.1.11 in volume F]
Lysozyme as an example
International Tables for Crystallography (2012). Vol. F, Section 9.1.10, pp. 222-223 [ doi:10.1107/97809553602060000824 ]
Lysozyme as an example 9.1.10. Lysozyme as an example Tetragonal hen egg-white lysozyme (Chapter 25.1 and Blake et al., 1967), crystallizing in the space group with cell dimensions a = b = 78.6 and c = 37.2Å, is used here as a model system to illustrate some of the points made above, based ...
Wavelength
International Tables for Crystallography (2012). Vol. F, Section 9.1.9, p. 222 [ doi:10.1107/97809553602060000824 ]
Wavelength 9.1.9. Wavelength The wavelength of X-radiation can be tuned only at synchrotron sources. Rotating-anode generators produce radiation at a fixed wavelength which is characteristic of the metal of the anode, usually copper with [lambda] = 1.542Å. The proper selection of the wavelength is most important for collecting data ...
Crystal-to-detector distance
International Tables for Crystallography (2012). Vol. F, Section 9.1.8, pp. 221-222 [ doi:10.1107/97809553602060000824 ]
Crystal-to-detector distance 9.1.8. Crystal-to-detector distance The crystal-to-detector distance (CTDD) should be selected so that the whole area of the detector is usefully exploited. The shorter the CTDD, the higher the resolution of the indexed reflections at the edge of the image; but if the CTDD ...
Alternative indexing
International Tables for Crystallography (2012). Vol. F, Section 9.1.7.4, p. 221 [ doi:10.1107/97809553602060000824 ]
Alternative indexing 9.1.7.4. Alternative indexing If the crystal point-group symmetry is lower than the symmetry of its Bravais lattice, then the reflections can be indexed in more than one way. In other words, the symmetry of the reflection positions is higher than the symmetry of the distribution of their intensities. ...
[more results from section 9.1.7 in volume F]
Wide slicing
International Tables for Crystallography (2012). Vol. F, Section 9.1.6.7, pp. 215-217 [ doi:10.1107/97809553602060000824 ]
Wide slicing 9.1.6.7. Wide slicing The object of the wide-slicing approach is to acquire the data on as small a number of individual exposures as possible. It involves large [Delta][varphi] values per image, usually of the order of 0.5° or more, which exceed the angular spread. Each image contains ...
[more results from section 9.1.6 in volume F]
The screenless rotation method and 2D detectors
International Tables for Crystallography (2012). Vol. F, Section 9.1.5.2, pp. 212-213 [ doi:10.1107/97809553602060000824 ]
... PILATUS 1M detector. J. Synchrotron Rad. 13, 120-130. Gruner, S. M. & Ealick, S. E. (1995). Charge coupled device X-ray detectors for ...
[more results from section 9.1.5 in volume F]
Synchrotron storage rings
International Tables for Crystallography (2012). Vol. F, Section 9.1.4.2, p. 212 [ doi:10.1107/97809553602060000824 ]
... crystallography. Trends Biochem. Sci. 25, 637-643. Rosenbaum, G., Holmes, K. C. & Witz, J. (1971). Synchrotron radiation as a source ...
[more results from section 9.1.4 in volume F]
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