3V5I
The crystal structure of the mutant ClpP S98A (Staphylococcus aureus)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-11-05 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 |
| Unit cell lengths | 97.550, 109.730, 171.410 |
| Unit cell angles | 73.10, 78.68, 71.46 |
Refinement procedure
| Resolution | 24.800 - 2.800 |
| R-factor | 0.2173 |
| Rwork | 0.216 |
| R-free | 0.24151 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3qwd |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.357 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | REFMAC (5.6.0119) |
| Refinement software | REFMAC (5.6.0119) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 2.900 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.091 | 0.393 |
| Number of reflections | 150830 | |
| <I/σ(I)> | 5.55 | 1.67 |
| Completeness [%] | 95.6 | 96.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 0.18 M Magnesium acetate, 0.1 M Sodium cacodylate, 12% MPD, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
