2X7I
Crystal structure of mevalonate kinase from methicillin-resistant Staphylococcus aureus MRSA252
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2008-06-27 |
Detector | MARRESEARCH |
Spacegroup name | P 62 2 2 |
Unit cell lengths | 94.589, 94.589, 169.010 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 81.920 - 2.200 |
R-factor | 0.21335 |
Rwork | 0.211 |
R-free | 0.25730 |
Structure solution method | MIR |
Starting model (for MR) | NONE |
RMSD bond length | 0.008 |
RMSD bond angle | 1.070 |
Data reduction software | MOSFLM |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 81.920 | 2.260 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.100 | 0.370 |
Number of reflections | 17784 | |
<I/σ(I)> | 14.6 | 2.1 |
Completeness [%] | 80.3 | 50.2 |
Redundancy | 5.6 | 1.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 4 | 0.1 M CITRIC ACID PH 4.0, 3.6 M SODIUM CHLORIDE. THE CRYSTALS WERE CRYOPROTECTED BY ADDING 25% PEG400 INTO THE SCREEN SOLUTION. |