Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X12 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X12 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-07-25 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.99184, 0.91740, 0.91706 |
Spacegroup name | P 31 |
Unit cell lengths | 60.910, 60.910, 42.050 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.530 - 1.400 |
R-factor | 0.1653 |
Rwork | 0.164 |
R-free | 0.19490 |
Structure solution method | MAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.086 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHELXS |
Refinement software | PHENIX ((phenix.refine: 1.5_2)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.530 | 1.440 |
High resolution limit [Å] | 1.400 | 1.400 |
Number of reflections | 34179 | |
Completeness [%] | 99.5 | 99.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | ammonium sulfate, imidazole, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |