7YOB
Crystal structure of Aldehyde dehydrogenase 1A1 from mouse
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NFPSS BEAMLINE BL18U |
Synchrotron site | NFPSS |
Beamline | BL18U |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-01-06 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.97915 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 104.062, 156.484, 129.209 |
Unit cell angles | 90.00, 97.97, 90.00 |
Refinement procedure
Resolution | 127.960 - 2.890 |
R-factor | 0.1963 |
Rwork | 0.195 |
R-free | 0.24930 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5l2n |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.19_4092) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 127.960 | 2.995 |
High resolution limit [Å] | 2.890 | 2.890 |
Rmerge | 0.035 | 0.295 |
Rmeas | 0.050 | 0.417 |
Rpim | 0.035 | 0.295 |
Number of reflections | 85287 | 9049 |
<I/σ(I)> | 8.31 | 2.32 |
Completeness [%] | 93.2 | |
Redundancy | 1.9 | |
CC(1/2) | 0.999 | 0.853 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 289 | 0.2 M potassium iodide (pH 7.0) and 20% (w/v) polyethylene glycol 3,350 |