7A19
2,3-Dihydroxybenzoate Decarboxylase of Aspergillus oryzae
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PETRA III, DESY BEAMLINE P11 |
Synchrotron site | PETRA III, DESY |
Beamline | P11 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-04-24 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.0332 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 99.794, 99.794, 129.177 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.640 - 1.210 |
R-factor | 0.1426 |
Rwork | 0.141 |
R-free | 0.17130 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2dvt |
RMSD bond length | 0.007 |
RMSD bond angle | 0.994 |
Data reduction software | DIALS |
Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.640 | 1.254 |
High resolution limit [Å] | 1.210 | 1.210 |
Rmerge | 0.123 | 0.764 |
Number of reflections | 165014 | 2990 |
<I/σ(I)> | 6.99 | 1.07 |
Completeness [%] | 83.1 | |
Redundancy | 4.2 | |
CC(1/2) | 0.986 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293.15 | 0.1 M magnesium chloride 0.1 M Na HEPES 7.5 10 % w/v PEG 4000 |