4RNU
G303 Circular Permutation of Old Yellow Enzyme
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-BM |
Synchrotron site | APS |
Beamline | 22-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-03-25 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.00000 |
Spacegroup name | P 1 |
Unit cell lengths | 45.662, 87.642, 113.572 |
Unit cell angles | 69.32, 82.56, 90.02 |
Refinement procedure
Resolution | 38.780 - 2.677 |
R-factor | 0.2483 |
Rwork | 0.247 |
R-free | 0.28300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1oya |
RMSD bond length | 0.002 |
RMSD bond angle | 0.502 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.780 | 2.790 |
High resolution limit [Å] | 2.677 | 2.677 |
Rmerge | 0.107 | 0.829 |
Number of reflections | 42123 | |
<I/σ(I)> | 13.8 | 1.9 |
Completeness [%] | 92.0 | 92.5 |
Redundancy | 6 | 5.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 289 | 18% PEG 3350, 0.2 M MgCl2, 0.25% glucoside, 0.1 M HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K |