8OGM
Crystal structure of CdaA from Bacillus subtilis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.2 |
Synchrotron site | BESSY |
Beamline | 14.2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-12-07 |
Detector | DECTRIS PILATUS3 2M |
Wavelength(s) | 0.91840 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 119.360, 39.480, 68.230 |
Unit cell angles | 90.00, 95.37, 90.00 |
Refinement procedure
Resolution | 37.470 - 1.100 |
R-factor | 0.1725 |
Rwork | 0.171 |
R-free | 0.20110 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 1.210 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 4.920 | 1.130 |
High resolution limit [Å] | 1.100 | 3.480 | 1.100 |
Rmerge | 0.036 | 0.022 | 1.613 |
Rmeas | 0.042 | 0.026 | 1.862 |
Number of reflections | 117659 | 2508 | 8066 |
<I/σ(I)> | 13.75 | ||
Completeness [%] | 91.5 | ||
Redundancy | 3.8 | ||
CC(1/2) | 0.999 | 0.999 | 0.605 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M Hepes pH 7.5 0.2 M Magnesium chloride 30% (v/v) PEG 400 |