6SE3
Crystal Structure of Ancestral Flavin-containing monooxygenase (FMO) 3-6
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 | 2018-12-15 |
Detector | DECTRIS PILATUS 2M-F |
Wavelength(s) | 0.98 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 156.089, 156.089, 370.605 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.300 - 2.800 |
R-factor | 0.219 |
Rwork | 0.217 |
R-free | 0.26600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5nmw |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.300 | 2.850 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.235 | 2.876 |
Number of reflections | 129389 | 6372 |
<I/σ(I)> | 14.3 | 1.3 |
Completeness [%] | 100.0 | |
Redundancy | 20.3 | |
CC(1/2) | 0.998 | 0.409 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 293 | PEG 4000, Sodium Acetate |