2R1T
dopamine quinone conjugation to DJ-1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-BM |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-06-22 |
Wavelength(s) | 1 |
Spacegroup name | P 31 |
Unit cell lengths | 75.468, 75.468, 75.504 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 21.790 - 1.700 |
Rwork | 0.208 |
R-free | 0.23600 |
Structure solution method | MOLECULAR REPLACEMENT |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 1.700 |
Rmerge | 0.086 |
Number of reflections | 52340 |
<I/σ(I)> | 20 |
Completeness [%] | 97.0 |
Redundancy | 6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 290 | 29% PEG4K, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 290K |