3TQN
Structure of the transcriptional regulator of the GntR family, from Coxiella burnetii.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4C |
| Synchrotron site | NSLS |
| Beamline | X4C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-07-28 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 68.057, 68.057, 194.466 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 46.938 - 2.800 |
| R-factor | 0.2638 |
| Rwork | 0.262 |
| R-free | 0.29630 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 1.091 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.6.4_486) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.750 |
| High resolution limit [Å] | 2.700 | 7.320 | 2.700 |
| Rmerge | 0.074 | 0.039 | 0.762 |
| Number of reflections | 13383 | ||
| <I/σ(I)> | 13.9 | ||
| Completeness [%] | 100.0 | 99.6 | 100 |
| Redundancy | 20.6 | 21 | 13.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 4 | 293 | 100 mM Trisodium Citrate 20% PEG 6000, pH 4.0, sitting drop, temperature 293K |
