5KQA
Crystal structure of buckwheat glutaredoxin-glutathione complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL18U1 |
Synchrotron site | SSRF |
Beamline | BL18U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-04-26 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.978 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 43.011, 92.299, 28.133 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.986 - 2.050 |
R-factor | 0.1682 |
Rwork | 0.163 |
R-free | 0.21620 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2e7p |
RMSD bond length | 0.007 |
RMSD bond angle | 0.990 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.090 |
High resolution limit [Å] | 2.050 | 2.050 |
Rmerge | 0.131 | |
Number of reflections | 7521 | |
<I/σ(I)> | 32 | 17.39 |
Completeness [%] | 98.5 | 96.6 |
Redundancy | 5.4 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 300 | 0.1M CH3COONa pH=4.5 20%-24% PEG3350 (W/V) |