2HK2
Crystal structure of mevalonate diphosphate decarboxylase from Staphylococcus aureus (monoclinic form)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-3 |
| Synchrotron site | ESRF |
| Beamline | ID14-3 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-11-13 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.931 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 85.495, 53.061, 100.882 |
| Unit cell angles | 90.00, 94.82, 90.00 |
Refinement procedure
| Resolution | 46.920 - 2.300 |
| R-factor | 0.191 |
| Rwork | 0.191 |
| R-free | 0.24900 |
| Structure solution method | SAD |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.805 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.920 | 2.420 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.102 | 0.295 |
| Total number of observations | 30232 | |
| Number of reflections | 40530 | |
| <I/σ(I)> | 6.6 | 2.5 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 5.2 | 5.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 0.1M Tris, 1.8M sodium malonate, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
