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 |