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) |
