Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 83 |
Detector technology | CCD |
Collection date | 2010-02-08 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.963937, 0.979163, 0.979328 |
Spacegroup name | I 41 2 2 |
Unit cell lengths | 164.656, 164.656, 273.458 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 14.965 - 4.000 |
R-factor | 0.2732 |
Rwork | 0.270 |
R-free | 0.33990 |
Structure solution method | MAD |
RMSD bond length | 0.048 |
RMSD bond angle | 1.747 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHARP |
Refinement software | PHENIX ((phenix.refine: 1.6.4_486)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 4.302 |
High resolution limit [Å] | 4.000 | 4.000 |
Rmerge | 0.056 | 0.056 |
Number of reflections | 13319 | |
<I/σ(I)> | 25.3 | 25.3 |
Completeness [%] | 97.3 | 97.3 |
Redundancy | 6.9 | 6.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 5.6 | 277 | 1.8M K/Na phosphate, pH 5.6, VAPOR DIFFUSION, temperature 277K |