5MZW
Crystal structure of the decarboxylase AibA/AibB
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-04-19 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9184 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 66.714, 93.600, 90.324 |
Unit cell angles | 90.00, 104.32, 90.00 |
Refinement procedure
Resolution | 43.758 - 1.520 |
R-factor | 0.1419 |
Rwork | 0.141 |
R-free | 0.15680 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 0.859 |
Data reduction software | XDS |
Data scaling software | Aimless (0.1.29) |
Phasing software | PHENIX |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 46.800 | 46.800 | 1.550 |
High resolution limit [Å] | 1.520 | 8.330 | 1.520 |
Rmerge | 0.149 | 0.063 | 0.830 |
Rmeas | 0.161 | ||
Rpim | 0.061 | ||
Total number of observations | 1140065 | ||
Number of reflections | 164999 | ||
<I/σ(I)> | 12.1 | ||
Completeness [%] | 100.0 | 99.5 | 100 |
Redundancy | 6.9 | 7 | 7 |
CC(1/2) | 0.997 | 0.996 | 0.878 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M MES pH 5.0, 12 % PEG6000 |