5C1Z
Parkin (UblR0RBR)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-11-23 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | .9174 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 67.310, 67.320, 206.230 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 56.360 - 1.790 |
| R-factor | 0.1925 |
| Rwork | 0.192 |
| R-free | 0.21230 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4k95 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.940 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | BALBES |
| Refinement software | BUSTER (2.10.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.360 | 1.850 |
| High resolution limit [Å] | 1.790 | 1.790 |
| Rmerge | 0.049 | 0.560 |
| Number of reflections | 87891 | |
| <I/σ(I)> | 11.2 | 1.8 |
| Completeness [%] | 98.8 | 97.6 |
| Redundancy | 3.1 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 5.5 | 277 | LiSO4, PEG3350 |






