2CA5
MxiH needle protein of Shigella Flexneri (monomeric form, residues 1- 78)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-07-31 |
Detector | ADSC CCD |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 183.203, 28.123, 27.723 |
Unit cell angles | 90.00, 96.47, 90.00 |
Refinement procedure
Resolution | 28.000 - 2.100 |
R-factor | 0.194 |
Rwork | 0.194 |
Structure solution method | MIRAS |
RMSD bond length | 0.006 |
RMSD bond angle | 0.879 |
Data scaling software | SCALA |
Phasing software | SHARP |
Refinement software | TNT (5.6.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.000 | 2.210 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.070 | 0.250 |
Number of reflections | 8232 | |
<I/σ(I)> | 7.7 | 2.9 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 4.3 | 4.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.6 | 20% PEG 4000, 0.1 M SODIUM CITRATE PH 5.6, 20% ISOPROPANOL, 10% GLYCEROL |