3E8T
Crystal Structure of Epiphyas postvittana Takeout 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2007-08-07 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 45.454, 45.178, 53.778 |
Unit cell angles | 90.00, 108.84, 90.00 |
Refinement procedure
Resolution | 31.160 - 1.300 |
R-factor | 0.144 |
Rwork | 0.142 |
R-free | 0.18200 |
Structure solution method | SAD |
RMSD bond length | 0.017 |
RMSD bond angle | 1.665 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.2.33) |
Phasing software | SHARP |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 33.787 | 1.370 |
High resolution limit [Å] | 1.300 | 1.300 |
Rmerge | 0.041 | 0.407 |
Total number of observations | 26815 | |
Number of reflections | 48865 | |
<I/σ(I)> | 1.9 | |
Completeness [%] | 96.1 | 78.3 |
Redundancy | 6.9 | 4.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.5 | 291 | 50mM MES pH 6.2-6.7, 20-25% PEG 3000, pH 6.5, VAPOR DIFFUSION, temperature 291K |
1 | VAPOR DIFFUSION | 6.5 | 291 | 50mM MES pH 6.2-6.7, 20-25% PEG 3000, pH 6.5, VAPOR DIFFUSION, temperature 291K |