3FVV
The crystal structure of the protein with unknown function from Bordetella pertussis Tohama I
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-04-24 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 86.398, 86.398, 219.276 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 70.890 - 2.100 |
| R-factor | 0.18429 |
| Rwork | 0.182 |
| R-free | 0.23521 |
| Structure solution method | SAD |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.726 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | REFMAC (5.5.0054) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 70.890 | 2.155 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.220 | 0.688 |
| Number of reflections | 27601 | |
| <I/σ(I)> | 15.49 | 1.96 |
| Completeness [%] | 99.6 | 99.53 |
| Redundancy | 21.7 | 16.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 289 | 1.0M di-Ammonium Hydrogen Phosphate, 0.1M Tris, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
