8DTQ
Crystal Structure of Staphylococcus aureus pSK41 Cop
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-D |
Synchrotron site | APS |
Beamline | 23-ID-D |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-07-02 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.97942 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 38.460, 56.261, 46.018 |
Unit cell angles | 90.00, 104.34, 90.00 |
Refinement procedure
Resolution | 44.580 - 1.450 |
R-factor | 0.1903 |
Rwork | 0.188 |
R-free | 0.22270 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 0.791 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.580 | 1.504 |
High resolution limit [Å] | 1.450 | 1.450 |
Rmerge | 0.077 | |
Rmeas | 0.108 | 0.700 |
Number of reflections | 33440 | 3284 |
<I/σ(I)> | 14.4 | 1.72 |
Completeness [%] | 99.5 | 98.44 |
Redundancy | 2 | 2 |
CC(1/2) | 0.991 | 0.673 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 298 | 3M sodium chloride, 0.1M sodium acetate pH 4.5 |