9EMU
RosC-8-demethyl-8-amino-FMN - Phosphate complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-04-05 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 |
Unit cell lengths | 51.850, 51.900, 81.820 |
Unit cell angles | 73.46, 81.72, 70.52 |
Refinement procedure
Resolution | 34.820 - 1.400 |
R-factor | 0.1649 |
Rwork | 0.164 |
R-free | 0.20300 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.868 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.500 |
High resolution limit [Å] | 1.400 | 12.000 | 1.400 |
Rmerge | 0.053 | 0.024 | 0.760 |
Rmeas | 0.063 | 0.029 | 0.906 |
Number of reflections | 138597 | 219 | 20562 |
<I/σ(I)> | 15.7 | ||
Completeness [%] | 91.4 | ||
Redundancy | 3.6 | ||
CC(1/2) | 0.998 | 0.998 | 0.716 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 5.7 | 293 | PEG 1500, TBG, pH 5.5, KH2PO4 pH 7.4 |