6QAP
Structure of the human aldehyde dehydrogenase 9A1 in C2 space group
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-12-08 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.97 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 164.290, 160.030, 84.600 |
Unit cell angles | 90.00, 91.09, 90.00 |
Refinement procedure
Resolution | 47.740 - 2.300 |
R-factor | 0.222 |
Rwork | 0.220 |
R-free | 0.25100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6qak |
RMSD bond length | 0.010 |
RMSD bond angle | 1.160 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | BUSTER (2.10.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.740 | 2.440 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.152 | |
Number of reflections | 96851 | |
<I/σ(I)> | 9.89 | |
Completeness [%] | 99.7 | |
Redundancy | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 292 | 14% PEG 4K, 0.1 M sodium citrate pH 5.6 |