5MR6
XiaF from Streptomyces sp. in complex with FADH2 and Glycerol
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 | 2016-10-15 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 |
Unit cell lengths | 166.930, 167.090, 200.940 |
Unit cell angles | 89.96, 90.18, 119.82 |
Refinement procedure
Resolution | 15.000 - 2.400 |
R-factor | 0.19975 |
Rwork | 0.198 |
R-free | 0.22881 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5lvw |
RMSD bond length | 0.012 |
RMSD bond angle | 1.654 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.500 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.098 | 0.578 |
Number of reflections | 703582 | |
<I/σ(I)> | 7.4 | 2 |
Completeness [%] | 95.5 | 94.8 |
Redundancy | 1.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 1.6 M (NH4)2SO4, 0.1 M HEPES, 0.1 M NaCl, 0.1 M NADH, 0.15 M FAD, 10% Glycerol, anaerobic crystallization 0.0005 mM XiaP (protein, reductase) |