8Q8J
Crystal structure of human GPX4-R152H
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-08-28 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1.000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 38.871, 45.048, 82.954 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.590 - 2.000 |
R-factor | 0.222 |
Rwork | 0.221 |
R-free | 0.24630 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 0.887 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.050 | 8.900 |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 8691 | 671 |
<I/σ(I)> | 7.1 | |
Completeness [%] | 86.2 | |
Redundancy | 7.4 | |
CC(1/2) | 0.990 | 0.580 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 20% w/v PEG monomethylether 5000 200 mM lithium sulphate |