Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9788, 0.9791, 0.9184, 1.009 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 184.274, 184.274, 260.485 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 3.700 |
Rwork | 0.293 |
R-free | 0.32100 |
Structure solution method | MAD |
Starting model (for MR) | 1MXM |
RMSD bond length | 0.010 |
RMSD bond angle | 1.636 |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.810 |
High resolution limit [Å] | 3.700 | 3.700 |
Rmerge | 0.956 | |
Number of reflections | 48452 | |
<I/σ(I)> | 20.7 | 2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 8.1 | 7.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 277 | PEG 3350, AMMONIUM CHLORIDE, CITRATE, FOSHOLINE-14, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 277K |