6EO4
Physcomitrella patens BBE-like 1 wild-type
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-F |
Wavelength(s) | 1.009 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 149.230, 149.230, 205.570 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.592 - 2.900 |
R-factor | 0.1837 |
Rwork | 0.182 |
R-free | 0.20860 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PpBBE-like 1 D396N variant |
RMSD bond length | 0.009 |
RMSD bond angle | 1.053 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 48.592 | 48.592 | 3.000 |
High resolution limit [Å] | 2.900 | 10.000 | 2.900 |
Rmerge | 0.264 | 0.060 | 2.405 |
Rmeas | 0.269 | 0.061 | 2.451 |
Number of reflections | 52047 | 1420 | 4943 |
<I/σ(I)> | 13.4 | 43.1 | 1.64 |
Completeness [%] | 99.9 | 98.8 | 100 |
Redundancy | 25.917 | 22.082 | 26.531 |
CC(1/2) | 0.998 | 0.999 | 0.662 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M Mg(OOCH)2, 13/14 % PEG 3350 |