3OCJ
The crystal structure of a possilbe exported protein from Bordetella parapertussis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-08-06 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 0.97926 |
| Spacegroup name | P 2 2 21 |
| Unit cell lengths | 48.233, 49.312, 145.053 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 24.656 - 1.390 |
| R-factor | 0.1885 |
| Rwork | 0.187 |
| R-free | 0.21100 |
| Structure solution method | SAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.092 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | SHELXD |
| Refinement software | PHENIX ((phenix.refine: 1.5_2)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 1.410 |
| High resolution limit [Å] | 1.390 | 1.390 |
| Rmerge | 0.073 | 0.702 |
| Number of reflections | 69592 | |
| <I/σ(I)> | 33.6 | 1.53 |
| Completeness [%] | 98.4 | 97.3 |
| Redundancy | 5.5 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 277 | 0.1M imidazole, 1.0M Sodium Acetate, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
