4B5N
Crystal structure of oxidized Shewanella Yellow Enzyme 4 (SYE4)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 52.230, 54.810, 103.550 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.442 - 1.100 |
| R-factor | 0.1272 |
| Rwork | 0.127 |
| R-free | 0.14050 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2gou |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.426 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.200 |
| High resolution limit [Å] | 1.100 | 1.100 |
| Rmerge | 0.050 | 0.340 |
| Number of reflections | 120389 | |
| <I/σ(I)> | 18.3 | 4.9 |
| Completeness [%] | 99.8 | 99.8 |
| Redundancy | 4.5 | 5.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.3 | 1.6M SODIUM CITRATE TRIBASIC DIHYDRATE, PH 6.3 |
