Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-08-19 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.28367 |
Spacegroup name | P 41 2 2 |
Unit cell lengths | 42.900, 42.900, 260.200 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 27.490 - 1.790 |
R-factor | 0.22 |
Rwork | 0.218 |
R-free | 0.23800 |
Structure solution method | SAD |
RMSD bond length | 0.013 |
RMSD bond angle | 1.244 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 30.500 |
High resolution limit [Å] | 1.790 |
Number of reflections | 41701 |
<I/σ(I)> | 7 |
Completeness [%] | 94.0 |
Redundancy | 4.3 |
CC(1/2) | 0.998 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 8 | 293 | PEG 3000, imidazole, zinc acetate |