4ASK
CRYSTAL STRUCTURE OF JMJD3 WITH GSK-J1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-09-29 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 |
| Unit cell lengths | 61.359, 65.554, 77.392 |
| Unit cell angles | 85.98, 67.69, 68.42 |
Refinement procedure
| Resolution | 71.370 - 1.860 |
| R-factor | 0.16646 |
| Rwork | 0.165 |
| R-free | 0.20882 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2xue |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.083 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 1.890 |
| High resolution limit [Å] | 1.860 | 1.860 |
| Rmerge | 0.070 | 0.360 |
| Number of reflections | 83457 | |
| <I/σ(I)> | 12.5 | 1.9 |
| Completeness [%] | 96.3 | 93.4 |
| Redundancy | 1.9 | 1.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.5 | 0.1M TRIS HCL, BICINE PH 8.5, 37.5% MPD, PEG1K, PEG3350, 0.03M MGCL2, 0.03M CACL2 |
