5IIW
Corkscrew assembly of SOD1 residues 28-38 without potassium iodide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-12-09 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9791 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 30.890, 43.230, 70.970 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.490 - 2.000 |
R-factor | 0.2401 |
Rwork | 0.239 |
R-free | 0.25240 |
Structure solution method | SIRAS |
RMSD bond length | 0.010 |
RMSD bond angle | 0.910 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHELX |
Refinement software | BUSTER-TNT |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 35.490 | 35.490 | 2.150 |
High resolution limit [Å] | 2.000 | 5.470 | 2.000 |
Rmerge | 0.122 | 0.050 | 0.593 |
Number of reflections | 6691 | ||
<I/σ(I)> | 9.34 | 16.66 | 3.13 |
Completeness [%] | 97.8 | 96.3 | 97.7 |
Redundancy | 5.1 | 5.23 | |
CC(1/2) | 0.992 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 298 | reservoir contained 13% PEG 6000, 0.2M Sodium Citrate |