5U8K
RitR mutant - C128S
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-F |
Synchrotron site | APS |
Beamline | 21-ID-F |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-07-16 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.97872 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 141.128, 60.079, 53.324 |
Unit cell angles | 90.00, 96.00, 90.00 |
Refinement procedure
Resolution | 40.329 - 1.690 |
R-factor | 0.1466 |
Rwork | 0.146 |
R-free | 0.16860 |
Structure solution method | SAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.030 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | autoSHARP |
Refinement software | PHENIX ((1.10_2148: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.330 | 1.750 |
High resolution limit [Å] | 1.690 | 1.690 |
Rmerge | 0.090 | 0.340 |
Number of reflections | 91682 | |
<I/σ(I)> | 16.6 | 8.1 |
Completeness [%] | 99.6 | 97.9 |
Redundancy | 5.6 | 5.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 8 | 294 | 0.1 M ammonium acetate, 25% PEG 3350 |