3H8Q
Crystal structure of glutaredoxin domain of human thioredoxin reductase 3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-03-27 |
Detector | MAR225 CCD |
Wavelength(s) | 1.000 |
Spacegroup name | P 61 |
Unit cell lengths | 71.130, 71.130, 72.291 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 31.910 - 2.210 |
R-factor | 0.19128 |
Rwork | 0.189 |
R-free | 0.23271 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2e7p |
RMSD bond length | 0.015 |
RMSD bond angle | 1.330 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0089) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 31.910 | 2.320 |
High resolution limit [Å] | 2.210 | 2.210 |
Rmerge | 0.083 | 0.951 |
Number of reflections | 10544 | |
<I/σ(I)> | 15.8 | 2.5 |
Completeness [%] | 100.0 | 100 |
Redundancy | 11.5 | 8.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293.15 | 2.0M Ammonium sulphate; 0.1M HEPES, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293.15K |