5MUX
Crystal structure of 2-methylcitrate dehydratase (MmgE) from Bacillus subtilis.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-05-07 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.9686 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 90.831, 194.409, 90.869 |
Unit cell angles | 90.00, 92.74, 90.00 |
Refinement procedure
Resolution | 30.800 - 2.000 |
R-factor | 0.15279 |
Rwork | 0.151 |
R-free | 0.18926 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.014 |
RMSD bond angle | 1.484 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 30.800 |
High resolution limit [Å] | 2.000 |
Number of reflections | 200076 |
<I/σ(I)> | 4.5 |
Completeness [%] | 99.5 |
Redundancy | 6.3 |
CC(1/2) | 0.640 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.2 M potassium/sodium tartrate, 20 % w/v PEG 3350. |