3VUQ
Crystal structure of TTHA0167, a transcriptional regulator, TetR/AcrR family from Thermus thermophilus HB8
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL26B2 |
| Synchrotron site | SPring-8 |
| Beamline | BL26B2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-07-06 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 44.327, 174.821, 56.158 |
| Unit cell angles | 90.00, 92.43, 90.00 |
Refinement procedure
| Resolution | 30.320 - 2.050 |
| R-factor | 0.201 |
| Rwork | 0.201 |
| R-free | 0.25000 |
| Structure solution method | SAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.100 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | CNS (1.3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.090 |
| High resolution limit [Å] | 2.040 | 2.040 |
| Rmerge | 0.046 | 0.266 |
| Number of reflections | 53147 | |
| <I/σ(I)> | 29.1 | 5.77 |
| Completeness [%] | 98.2 | 79.1 |
| Redundancy | 4.2 | 4.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 4.6 | 293 | 30% PEG300, 0.2M phosphate citrate, 0.15M lithium chloride, pH 4.6, micro-batch, temperature 293.0K |
