3VOX
X-ray Crystal Structure of Wild Type HrtR in the Apo Form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL41XU |
| Synchrotron site | SPring-8 |
| Beamline | BL41XU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-01-23 |
| Detector | RAYONIX MX225HE |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 90.837, 190.180, 152.842 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.902 - 3.100 |
| R-factor | 0.187 |
| Rwork | 0.184 |
| R-free | 0.24130 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.266 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (2.3.0) |
| Refinement software | PHENIX (1.7.3_928) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 3.200 |
| High resolution limit [Å] | 3.100 | 3.100 |
| Number of reflections | 24781 | |
| <I/σ(I)> | 22.5 | 5.14 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 7.5 | 7.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 293 | 1.2M sodium citrate, 0.1M HEPES, 0.2M ammonium acetate, pH 7.5, vapor diffusion, sitting drop, temperature 293K |
