2VIX
Methylated Shigella flexneri MxiC
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 294 |
Detector technology | CCD |
Collection date | 2007-07-04 |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 88.791, 102.572, 122.638 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.400 - 2.850 |
R-factor | 0.244 |
Rwork | 0.244 |
R-free | 0.27300 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.821 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | TNT (5.13.1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.400 | 3.000 |
High resolution limit [Å] | 2.850 | 2.850 |
Rmerge | 0.110 | 0.490 |
Number of reflections | 84697 | |
<I/σ(I)> | 10.7 | 2.4 |
Completeness [%] | 98.6 | 93.3 |
Redundancy | 3.2 | 2.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 0.2M NAACETATE, 0.1 BISTRIS PROPANE PH 7.5, 20% PEG3350 |