4XWX
Crystal structure of the PTB domain of SHC
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-04-14 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 0.97949 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 64.910, 126.790, 50.400 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.980 - 1.870 |
R-factor | 0.16887 |
Rwork | 0.168 |
R-free | 0.19096 |
RMSD bond length | 0.016 |
RMSD bond angle | 1.644 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | SHARP |
Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.980 | 1.970 |
High resolution limit [Å] | 1.870 | 1.870 |
Rmerge | 0.060 | 0.823 |
Number of reflections | 17581 | |
<I/σ(I)> | 13.4 | 2.1 |
Completeness [%] | 99.9 | 100 |
Redundancy | 5.3 | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 277.15 | 0.8 M sodium/potassium tartrate, 0.1 M Hepes pH 7.5 |