8ACS
Crystal structure of FMO from Janthinobacterium svalbardensis
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 | 2021-07-05 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.34024 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 142.302, 316.361, 65.647 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.440 - 2.500 |
R-factor | 0.1844 |
Rwork | 0.182 |
R-free | 0.22890 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | AF-Model |
RMSD bond length | 0.009 |
RMSD bond angle | 1.056 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (19) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.591 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.095 | 0.771 |
Rmeas | 0.098 | 0.801 |
Rpim | 0.026 | 0.214 |
Number of reflections | 92245 | 10156 |
<I/σ(I)> | 20.01 | |
Completeness [%] | 89.0 | 99.3 |
Redundancy | 13.5 | 13.5 |
CC(1/2) | 0.999 | 0.922 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 277.15 | Crystallophore LuXo4, 14% PEG 8000, 17.5% Glycerol, 100 mM BIS-TRIS buffer (pH 6.5). |