6ZTI
Phospholipase PlaB from Legionella pneumophila in complex with thio-NAD
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-04-06 |
Detector | DECTRIS PILATUS 2M-F |
Wavelength(s) | 1.21233 |
Spacegroup name | P 1 |
Unit cell lengths | 75.831, 90.725, 92.790 |
Unit cell angles | 78.44, 90.26, 75.41 |
Refinement procedure
Resolution | 46.910 - 1.810 |
R-factor | 0.188 |
Rwork | 0.186 |
R-free | 0.23400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | xxxx |
Data reduction software | XDS |
Data scaling software | STARANISO |
Phasing software | PHASER |
Refinement software | PHENIX (dev_3922) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.910 | 1.950 |
High resolution limit [Å] | 1.810 | 1.810 |
Rmerge | 0.390 | 2.380 |
Rmeas | 0.410 | 2.600 |
Rpim | 0.110 | 0.820 |
Number of reflections | 161898 | 8096 |
<I/σ(I)> | 7.3 | 1.6 |
Completeness [%] | 76.0 | |
Redundancy | 12.9 | |
CC(1/2) | 0.990 | 0.530 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 292 | 100 mM Tris pH 8.5, 8.33% glycerol, 10.8% 2-propanol |