3HDC
The crystal structure of thioredoxin protein from Geobacter metallireducens
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-04-23 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9788 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 63.678, 63.678, 94.587 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 35.900 - 1.771 |
R-factor | 0.1798 |
Rwork | 0.179 |
R-free | 0.19660 |
Structure solution method | SAD |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SOLVE |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.800 |
High resolution limit [Å] | 1.770 | 1.770 |
Rmerge | 0.060 | 0.378 |
Number of reflections | 21827 | |
<I/σ(I)> | 15.6 | |
Completeness [%] | 99.9 | 100 |
Redundancy | 11.5 | 11.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 3.5 | 0.1 M Citric acid pH 3.5, 3.0 M Sodium chloride, VAPOR DIFFUSION, SITTING DROP |