5TWB
Oxidoreductase IruO in the reduced form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08B1-1 |
| Synchrotron site | CLSI |
| Beamline | 08B1-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-02-23 |
| Detector | RAYONIX MX300HE |
| Wavelength(s) | 0.976240 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 157.170, 43.600, 51.240 |
| Unit cell angles | 90.00, 93.44, 90.00 |
Refinement procedure
| Resolution | 41.715 - 1.822 |
| R-factor | 0.1905 |
| Rwork | 0.189 |
| R-free | 0.22690 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.847 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.8.4_1496) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 44.070 |
| High resolution limit [Å] | 1.820 |
| Rmerge | 0.083 |
| Number of reflections | 60420 |
| <I/σ(I)> | 8.2 |
| Completeness [%] | 100.0 |
| Redundancy | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.2 M magnesium acetate and 8-11% PEG 3350 |
