6ZE2
FAD-dependent oxidoreductase from Chaetomium thermophilum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1) |
Synchrotron site | PETRA III, EMBL c/o DESY |
Beamline | P13 (MX1) |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-10-21 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.0332 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 46.654, 116.774, 109.903 |
Unit cell angles | 90.00, 90.80, 90.00 |
Refinement procedure
Resolution | 46.690 - 1.310 |
R-factor | 0.1072 |
Rwork | 0.106 |
R-free | 0.13700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ynt |
RMSD bond length | 0.013 |
RMSD bond angle | 1.825 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MoRDa (1.2.00) |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.690 | 1.330 |
High resolution limit [Å] | 1.310 | 1.310 |
Rmerge | 0.045 | 0.489 |
Rmeas | 0.053 | 0.599 |
Rpim | 0.029 | 0.340 |
Number of reflections | 268173 | 13444 |
<I/σ(I)> | 11.2 | 2 |
Completeness [%] | 95.4 | 96.8 |
Redundancy | 3.2 | 2.8 |
CC(1/2) | 0.999 | 0.795 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293.15 | 17 % (w/v) PEG MME 5000, 0.1 M sodium acetate, pH 5.5, 0.16 M magnesium formate, 20 mM cystamine, protein concentration 8 mg/ml |