5OVS
Thiobacillus denitrificans BPH
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-05-27 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 79.107, 175.230, 205.890 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.550 - 2.300 |
R-factor | 0.21034 |
Rwork | 0.208 |
R-free | 0.25523 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.188 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | SHELXDE |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.600 | 2.440 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.113 | 0.831 |
Number of reflections | 127579 | 20143 |
<I/σ(I)> | 11.7 | 1.98 |
Completeness [%] | 99.7 | 98.7 |
Redundancy | 5.22 | 5.14 |
CC(1/2) | 0.997 | 0.704 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 294 | 100 mM HEPES-NaOH pH 7.0, 600 mM NaF |