6F8O
AKR1B1 at 3.45 MGy radiation dose.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-05-23 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9017 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 47.380, 66.766, 49.580 |
Unit cell angles | 90.00, 92.00, 90.00 |
Refinement procedure
Resolution | 10.000 - 1.170 |
Rwork | 0.118 |
R-free | 0.16300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2j8t |
Data reduction software | XDS |
Data scaling software | Aimless |
Refinement software | SHELXL |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.550 | 1.190 |
High resolution limit [Å] | 1.170 | 1.170 |
Rmerge | 0.043 | 0.283 |
Number of reflections | 103347 | |
<I/σ(I)> | 15.2 | 4.6 |
Completeness [%] | 99.6 | 99.5 |
Redundancy | 3.7 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 298 | PEG 6000, AmCitrate |