5N1U
Structure of xEco2 acetyltransferase domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 93 |
Detector technology | PIXEL |
Collection date | 2016-06-29 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97949 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 58.475, 66.287, 109.763 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.834 - 2.976 |
R-factor | 0.2279 |
Rwork | 0.223 |
R-free | 0.26760 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4mxe |
RMSD bond length | 0.003 |
RMSD bond angle | 0.688 |
Data reduction software | xia2 |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.834 | 3.080 |
High resolution limit [Å] | 2.976 | 2.980 |
Rmerge | 0.297 | 1.160 |
Number of reflections | 9148 | |
<I/σ(I)> | 7.7 | 1.52 |
Completeness [%] | 99.0 | |
Redundancy | 6.1 | 5.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 0.2 M NaCl, 0.1 M imidazole pH 7 and 0.864 M ammonium phosphate |