2V4O
Crystal structure of Salmonella typhimurium SurE at 2.75 angstrom resolution in monoclinic form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Detector | MARRESEARCH |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 161.081, 95.299, 94.572 |
Unit cell angles | 90.00, 98.93, 90.00 |
Refinement procedure
Resolution | 93.250 - 2.710 |
R-factor | 0.19271 |
Rwork | 0.190 |
R-free | 0.25428 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1j9j |
RMSD bond length | 0.016 |
RMSD bond angle | 1.801 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.850 |
High resolution limit [Å] | 2.750 | 2.750 |
Rmerge | 0.080 | 0.500 |
Number of reflections | 37552 | |
<I/σ(I)> | 14.3 | 2.32 |
Completeness [%] | 99.6 | 99.8 |
Redundancy | 4.1 | 4.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 0.1 M MES (PH 6.5) AND 12% PEG 20,000 |