2Q7V
Crystal Structure of Deinococcus Radiodurans Thioredoxin Reductase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 8-BM |
| Synchrotron site | APS |
| Beamline | 8-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-08-22 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 83.994, 83.994, 160.110 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 19.360 - 1.900 |
| R-factor | 0.191 |
| Rwork | 0.188 |
| R-free | 0.24000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2A87 CHAIN B |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.715 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MrBUMP ((MOLREP)) |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 80.060 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.069 | 0.332 |
| Number of reflections | 49077 | |
| <I/σ(I)> | 21.6 | 21.6 |
| Completeness [%] | 93.6 | 93.6 |
| Redundancy | 6.4 | 6.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.1 | 293 | 35% PEG 4000, 0.2M ammonium acetate, citric acid buffer, VAPOR DIFFUSION, SITTING DROP, temperature 293K, pH 5.10 |
