2P6O
Crystal structure of TTHB049 from Thermus thermophilus HB8
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2006-11-02 |
| Detector | RIGAKU RAXIS VII |
| Wavelength(s) | 1.5418 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 83.853, 91.635, 111.428 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.620 - 1.650 |
| R-factor | 0.186 |
| Rwork | 0.186 |
| R-free | 0.19600 |
| Structure solution method | DIFFERENCE FOURIER |
| Starting model (for MR) | 1v37 |
| RMSD bond angle | 0.006 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | CNS (1.1) |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.710 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.082 | 0.429 |
| Number of reflections | 51923 | |
| <I/σ(I)> | 9 | 3.2 |
| Completeness [%] | 100.0 | 99.6 |
| Redundancy | 6.8 | 6.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 8.3 | 291 | 2.75M Sodium chloride, 0.1M Tris, pH 8.3, MICROBATCH, temperature 291K |
