Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | AREA DETECTOR |
Collection date | 1999-02-01 |
Detector | SIEMENS HI-STAR |
Wavelength(s) | 1.54 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 49.200, 56.100, 82.500 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.020 |
R-factor | 0.177 |
Rwork | 0.171 |
R-free | 0.25700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1shv |
RMSD bond length | 0.016 |
RMSD bond angle | 2.300 |
Data reduction software | X-GEN |
Data scaling software | X-GEN |
Phasing software | AMoRE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.140 |
High resolution limit [Å] | 2.020 | 2.020 |
Number of reflections | 13813 | |
<I/σ(I)> | 12.1 | 2.5 |
Completeness [%] | 95.0 | 72 |
Redundancy | 4.6 | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 15% PEG-6000, 50 mM HEPES, 0.56 mM Cymal-6, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 293.0K |