8EQ8
The crystal structure of 14-3-3 Beta containing 3-nitrotyrosine at position Y130
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.1 |
Synchrotron site | ALS |
Beamline | 5.0.1 |
Temperature [K] | 96 |
Detector technology | PIXEL |
Collection date | 2019-04-01 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.97 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 52.400, 124.510, 55.230 |
Unit cell angles | 90.00, 114.50, 90.00 |
Refinement procedure
Resolution | 29.090 - 1.500 |
R-factor | 0.1799 |
Rwork | 0.178 |
R-free | 0.20490 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2bq0 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.000 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.090 | 1.550 |
High resolution limit [Å] | 1.500 | 1.500 |
Number of reflections | 102662 | 9538 |
<I/σ(I)> | 14.78 | |
Completeness [%] | 99.8 | 99.9 |
Redundancy | 38.2 | |
CC(1/2) | 0.999 | 0.179 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 20%-30% PEG 550 MME, 50 mM MgCl2, 100 mM HEPES pH 7-8.3 |