6ZYK
Non-heme monooxygenase, ThoJ-Ni complex
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 | 2018-03-01 |
Detector | DECTRIS PILATUS 2M-F |
Wavelength(s) | 1 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 80.753, 80.753, 129.714 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.860 - 2.550 |
R-factor | 0.2277 |
Rwork | 0.227 |
R-free | 0.23810 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5ncj |
RMSD bond length | 0.004 |
RMSD bond angle | 0.756 |
Data reduction software | xia2 |
Data scaling software | Aimless |
Phasing software | Phaser-MR |
Refinement software | PHENIX ((1.18.2_3874)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 68.560 | 2.640 |
High resolution limit [Å] | 2.550 | 2.550 |
Rmeas | 0.120 | 0.954 |
Number of reflections | 14610 | 1414 |
<I/σ(I)> | 9.4 | |
Completeness [%] | 99.9 | |
Redundancy | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 150 mM Sodium tartrate, 28% (w/v) PEG 3350, 10% (v/v) 2.0 M NDSB-221 |