2VJ5
Shigella flexneri MxiC
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 173 |
Detector technology | CCD |
Collection date | 2007-06-22 |
Detector | ADSC CCD |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 91.370, 91.370, 215.840 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.600 - 3.000 |
R-factor | 0.246 |
Rwork | 0.246 |
R-free | 0.27000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2vix |
RMSD bond length | 0.005 |
RMSD bond angle | 0.773 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | TNT (5.13.1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.600 | 3.160 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.070 | 0.430 |
Number of reflections | 18676 | |
<I/σ(I)> | 14 | 4.5 |
Completeness [%] | 98.5 | 98.4 |
Redundancy | 6.9 | 7.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 0.2 M NA2SO4, 0.1 M BISTRISPROPANE PH 6.5, 20% PEG3350 |