5IP5
Human DJ-1 complexed with Na-K-tartrate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PAL/PLS BEAMLINE 7A (6B, 6C1) |
| Synchrotron site | PAL/PLS |
| Beamline | 7A (6B, 6C1) |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-07-10 |
| Detector | ADSC QUANTUM 270 |
| Wavelength(s) | 1.127 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 74.802, 74.802, 75.819 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 20.000 - 1.660 |
| R-factor | 0.14305 |
| Rwork | 0.142 |
| R-free | 0.16391 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3bwe |
| RMSD bond length | 0.027 |
| RMSD bond angle | 2.509 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.720 |
| High resolution limit [Å] | 1.660 | 1.660 |
| Number of reflections | 29365 | |
| <I/σ(I)> | 54.3 | |
| Completeness [%] | 99.8 | 100 |
| Redundancy | 2.1 | 1.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 6.5 | 295 | 1.5 M sodium potassium tartrate, 3.5 M ammonium sulfate, 0.1 M Na-Cacodylate |
