5NY5
The apo structure of 3,4-dihydroxybenzoic acid decarboxylases from Enterobacter cloacae
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 | 2014-01-28 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9796 |
Spacegroup name | H 3 2 |
Unit cell lengths | 209.907, 209.907, 162.179 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 48.060 - 2.501 |
R-factor | 0.2032 |
Rwork | 0.201 |
R-free | 0.23590 |
Structure solution method | SAD |
RMSD bond length | 0.003 |
RMSD bond angle | 0.560 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | AutoSol |
Refinement software | PHENIX ((1.10.1_2155)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.060 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.118 | 0.779 |
Number of reflections | 47197 | 4613 |
<I/σ(I)> | 22.3 | |
Completeness [%] | 100.0 | 99 |
Redundancy | 20 | 19.9 |
CC(1/2) | 0.999 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 289 | 0.15 M L-Arginine, 0.075 M sodium acetate pH 5.0, 6 % w/v PGA protein concentrations of 5.5 and 14 mg/mL |