Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-07-12 |
Detector | RIGAKU |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 49.187, 63.765, 64.742 |
Unit cell angles | 90.00, 91.81, 90.00 |
Refinement procedure
Resolution | 45.410 - 1.800 |
R-factor | 0.189 |
Rwork | 0.186 |
R-free | 0.23700 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.476 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.410 | 1.860 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 33633 | |
Completeness [%] | 89.7 | 49.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 300 | 0.1M BICINE pH 9.0, 27% PEG3350, 0.2M MgCl2, PH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 300K |