3HSR
Crystal structure of Staphylococcus aureus protein SarZ in mixed disulfide form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-B |
| Synchrotron site | APS |
| Beamline | 23-ID-B |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-10-13 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.9793 |
| Spacegroup name | P 1 |
| Unit cell lengths | 38.240, 62.840, 67.200 |
| Unit cell angles | 64.40, 75.81, 82.58 |
Refinement procedure
| Resolution | 50.000 - 1.900 |
| R-factor | 0.199 |
| Rwork | 0.196 |
| R-free | 0.24700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3hrm |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.440 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (1.3.3) |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.950 |
| High resolution limit [Å] | 1.880 | 4.050 | 1.880 |
| Rmerge | 0.042 | 0.021 | 0.299 |
| Number of reflections | 40152 | ||
| <I/σ(I)> | 17.541 | ||
| Completeness [%] | 91.0 | 98.2 | 64.7 |
| Redundancy | 1.9 | 2 | 1.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | 25% PEG 3350, 0.2 M ammonium acetate, 0.1 M TRIS, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
