5A8V
Crystal structure of Orgyia pseudotsugata CPV5 polyhedra with SeMet substitution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | MARRESEARCH |
Spacegroup name | I 2 3 |
Unit cell lengths | 102.054, 102.054, 102.054 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.082 - 2.074 |
R-factor | 0.1718 |
Rwork | 0.169 |
R-free | 0.22790 |
Structure solution method | SIRAS |
Starting model (for MR) | NONE |
RMSD bond length | 0.006 |
RMSD bond angle | 1.015 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | SHARP |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 72.200 | 2.140 |
High resolution limit [Å] | 2.070 | 2.070 |
Rmerge | 0.160 | 0.390 |
Number of reflections | 10902 | |
<I/σ(I)> | 7.5 | 1.9 |
Completeness [%] | 100.0 | 100 |
Redundancy | 64.1 | 26.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | pH 7.5 |