5J60
Structure of a thioredoxin reductase from Gloeobacter violaceus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-10-22 |
Detector | DECTRIS PILATUS 2M-F |
Wavelength(s) | 1.00004 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 83.278, 122.042, 139.153 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.222 - 1.900 |
R-factor | 0.1779 |
Rwork | 0.177 |
R-free | 0.20150 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2q7v |
RMSD bond length | 0.010 |
RMSD bond angle | 0.982 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((dev_2341: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.222 | 1.968 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.068 | 1.523 |
Number of reflections | 112104 | |
<I/σ(I)> | 24.02 | 1.59 |
Completeness [%] | 100.0 | 100 |
Redundancy | 13.3 | 12.3 |
CC(1/2) | 1.000 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 30 & PEG-400 0.1 M Natrium Acetate, pH 4.5 0.2 M Calcium acetate |