4ZG3
In-vacuum long-wavelength crystallography
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I23 |
Synchrotron site | Diamond |
Beamline | I23 |
Temperature [K] | 45 |
Detector technology | PIXEL |
Collection date | 2014-12-13 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.378 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 57.842, 57.842, 150.370 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 53.986 - 1.200 |
R-factor | 0.1477 |
Rwork | 0.147 |
R-free | 0.16750 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.174 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | SHARP |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 150.370 | 1.220 |
High resolution limit [Å] | 1.200 | 1.200 |
Rmerge | 0.037 | 0.760 |
Number of reflections | 138112 | |
<I/σ(I)> | 26.7 | 2.2 |
Completeness [%] | 89.9 | 79.9 |
Redundancy | 6.8 | 5.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.8 | 292 | 0.5 M K/Na Tartrate, 0.05 M ADA, ph6.8, 20 % glycerol |