4PGO
Crystal structure of hypothetical protein PF0907 from Pyrococcus furiosus solved by sulfur SAD using Swiss Light Source data
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-08-30 |
Detector | DECTRIS PILATUS 2M-F |
Wavelength(s) | 2.066 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 88.500, 88.500, 73.120 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 44.250 - 2.300 |
R-factor | 0.189 |
Rwork | 0.188 |
R-free | 0.20260 |
Structure solution method | SAD |
RMSD bond length | 0.009 |
RMSD bond angle | 1.076 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHELXDE |
Refinement software | PHENIX ((phenix.refine: 1.8.4_1496)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 2.300 |
Rmerge | 0.046 |
Number of reflections | 7558 |
<I/σ(I)> | 69.96 |
Completeness [%] | 95.0 |
Redundancy | 51.16 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 6.5 | 293 | MODIFIED MICROBATCH UNDER OIL USING 1.6M MAGNESIUM SULFATE IN 0.1M MES BUFFER, PH 6.5, TEMPERATURE 293K |