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 |
