Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44B2 |
Synchrotron site | SPring-8 |
Beamline | BL44B2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-03-23 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 94.754, 42.804, 50.699 |
Unit cell angles | 90.00, 96.28, 90.00 |
Refinement procedure
Resolution | 19.490 - 1.400 |
R-factor | 0.164 |
Rwork | 0.164 |
R-free | 0.18100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1mou |
RMSD bond length | 0.013 |
RMSD bond angle | 1.700 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.450 |
High resolution limit [Å] | 1.400 | 1.400 |
Rmerge | 0.042 | 0.256 |
Number of reflections | 36604 | |
<I/σ(I)> | 3 | |
Completeness [%] | 91.6 | 62.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 295 | 20% PEG 3350, 0.2M LICL, 20MM TRIS/HCL, pH 8.00, VAPOR DIFFUSION, SITTING DROP, temperature 295K |