4H6K
W116I mutant of OYE1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X6A |
| Synchrotron site | NSLS |
| Beamline | X6A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-08-15 |
| Detector | ADSC QUANTUM 270 |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 140.930, 140.930, 42.460 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 31.513 - 1.550 |
| R-factor | 0.1844 |
| Rwork | 0.182 |
| R-free | 0.20430 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3rnd |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.047 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.8_1069)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 32.320 | 1.630 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.080 | 0.916 |
| Number of reflections | 62580 | |
| <I/σ(I)> | 14.2 | 2.1 |
| Completeness [%] | 99.9 | 99.8 |
| Redundancy | 9.1 | 8.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.3 | 277 | 0.1M hepes, 0.2M MgCl2, peg400 35%, pH 8.3, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
