1V98
Crystal Structure Analysis of Thioredoxin from Thermus thermophilus
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 | 2003-12-04 |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 40.910, 95.441, 56.683 |
| Unit cell angles | 90.00, 91.41, 90.00 |
Refinement procedure
| Resolution | 56.800 - 1.820 |
| Rwork | 0.195 |
| R-free | 0.23600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDB ID 1NW2 A cahin |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.592 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.800 | 1.890 |
| High resolution limit [Å] | 1.820 | 1.820 |
| Rmerge | 0.082 | 0.500 |
| Number of reflections | 18770 | |
| <I/σ(I)> | 16 | 2.97 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 3.65 | 3.52 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 4.8 | 291 | Lithium sulfate, Sodium Acetate, pH 4.8, Micro batch, temperature 291K |
