Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL11-1 |
Synchrotron site | SSRL |
Beamline | BL11-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | MARMOSAIC 325 mm CCD |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 50.820, 68.530, 58.900 |
Unit cell angles | 90.00, 112.35, 90.00 |
Refinement procedure
Resolution | 20.390 - 1.550 |
R-factor | 0.1889 |
Rwork | 0.187 |
R-free | 0.21570 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2GOZ |
RMSD bond length | 0.004 |
RMSD bond angle | 0.945 |
Data reduction software | iMOSFLM |
Phasing software | PHENIX |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.390 | 1.630 |
High resolution limit [Å] | 1.550 | 1.550 |
Rmerge | 0.030 | 0.630 |
Number of reflections | 26462 | |
<I/σ(I)> | 13.9 | |
Completeness [%] | 97.6 | 99.6 |
Redundancy | 3 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 1.7M SODIUM MALONATE, PH 7.5 AND 1 MM MGCL2 |