3UOR
The structure of the sugar-binding protein MalE from the phytopathogen Xanthomonas citri
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-12-06 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.00662 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 122.971, 122.971, 304.280 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 47.818 - 2.202 |
R-factor | 0.191 |
Rwork | 0.189 |
R-free | 0.22820 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.078 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | SHARP |
Refinement software | PHENIX |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 2.200 |
Rmerge | 0.059 |
Number of reflections | 68944 |
Completeness [%] | 99.0 |
Redundancy | 10 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 298 | 0.1 M Tris HCl pH 8.0, 3.5 M sodium formate, VAPOR DIFFUSION, SITTING DROP, temperature 298.0K |
2 | VAPOR DIFFUSION, SITTING DROP | 8 | 298 | 0.1 M Tris HCl pH 8.0; 3.5 M Sodium Formate; heavy atom soaking with 1 mM mersalyl acid, VAPOR DIFFUSION, SITTING DROP, temperature 298.0K |