6TWM
Product bound structure of the Ectoine utilization protein EutE (DoeB) from Ruegeria pomeroyi
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 | 2019-03-16 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.9184 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 76.667, 145.949, 164.116 |
Unit cell angles | 90.00, 92.30, 90.00 |
Refinement procedure
Resolution | 46.640 - 2.500 |
R-factor | 0.2093 |
Rwork | 0.209 |
R-free | 0.26230 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6twl |
RMSD bond length | 0.004 |
RMSD bond angle | 0.748 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.640 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.213 | 1.275 |
Number of reflections | 122999 | 12342 |
<I/σ(I)> | 5.69 | 0.97 |
Completeness [%] | 98.6 | |
Redundancy | 3.9 | |
CC(1/2) | 0.984 | 0.421 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M Bicine pH 9.0, 20% (wt/vol) PEG 6000 |