5ECW
Structure of the Shigella flexneri VapC mutant D7A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I911-3 |
Synchrotron site | MAX II |
Beamline | I911-3 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-12-12 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.9795 |
Spacegroup name | H 3 |
Unit cell lengths | 120.100, 120.100, 52.530 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 23.440 - 1.940 |
R-factor | 0.1925 |
Rwork | 0.189 |
R-free | 0.22590 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.002 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX (dev_1839) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 23.440 |
High resolution limit [Å] | 1.940 |
Number of reflections | 1751 |
<I/σ(I)> | 30.77 |
Completeness [%] | 92.4 |
Redundancy | 6.25 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 292.15 | 0.2 M sodium malonate, 20% PEG 3350 |