6GSC
Sphingobacterium sp. T2 manganese superoxide dismutase catalyses the oxidative demethylation of polymeric lignin via generation of hydroxyl radical
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 | 2018-03-01 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97623 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 46.530, 58.610, 75.070 |
Unit cell angles | 90.00, 90.37, 90.00 |
Refinement procedure
Resolution | 39.660 - 1.320 |
R-factor | 0.15094 |
Rwork | 0.150 |
R-free | 0.16632 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 5a9g |
RMSD bond length | 0.014 |
RMSD bond angle | 1.583 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | FFT |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 1.390 |
High resolution limit [Å] | 1.320 | 1.320 |
Rmerge | 0.090 | 0.951 |
Rmeas | 0.093 | |
Rpim | 0.030 | |
Number of reflections | 94757 | 6973 |
<I/σ(I)> | 14.3 | 2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 9.9 | 9.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 291 | 130 mM ammonium citrate, 26% PEG 3350 |