5NIM
EthR complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-03-01 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9600 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 122.544, 122.544, 33.815 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 86.650 - 1.500 |
R-factor | 0.1766 |
Rwork | 0.175 |
R-free | 0.20424 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.017 |
RMSD bond angle | 1.698 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 86.650 | 1.600 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.080 | 0.570 |
Number of reflections | 41904 | 13798 |
<I/σ(I)> | 12.5 | |
Completeness [%] | 100.0 | 100 |
Redundancy | 6.7 | 6.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | MES buffer, 1.4-1.6 M Ammonium sulfate |