3KQ5
Crystal structure of an uncharacterized protein from Coxiella burnetii
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 31-ID |
| Synchrotron site | APS |
| Beamline | 31-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-10-08 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.97958 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 124.245, 41.375, 85.401 |
| Unit cell angles | 90.00, 115.61, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.000 |
| R-factor | 0.191 |
| Rwork | 0.189 |
| R-free | 0.22100 |
| Structure solution method | SAD |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.563 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.3.9) |
| Phasing software | SHELXCD |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.245 | 2.110 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.109 | 0.452 |
| Number of reflections | 25952 | |
| <I/σ(I)> | 10.9 | 3.6 |
| Completeness [%] | 96.7 | 96.2 |
| Redundancy | 6.2 | 6.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6.5 | 294 | 100mM Bis-Tris pH 6.5, 28% PEG 3350, 200mM ammonium acetate, vapor diffusion, temperature 294K |
