5DQA
t3284 loop variant of beta1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-10-14 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.91840 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 106.060, 115.710, 167.890 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 53.030 - 3.270 |
| R-factor | 0.18468 |
| Rwork | 0.183 |
| R-free | 0.21073 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.972 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 53.030 | 3.350 |
| High resolution limit [Å] | 3.270 | 3.270 |
| Rmerge | 0.062 | 0.670 |
| Number of reflections | 16280 | |
| <I/σ(I)> | 19 | 2.7 |
| Completeness [%] | 99.6 | 99.9 |
| Redundancy | 6.7 | 6.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6.5 | 290 | 0.1M MES pH 6.5, 1.6 M magnesium sulfate |
