5ZBC
Crystal structure of Se-Met tryptophan oxidase (C395A mutant) from Chromobacterium violaceum
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NE3A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NE3A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-06-06 |
| Detector | ADSC QUANTUM 270 |
| Wavelength(s) | 0.9789 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 87.980, 89.080, 113.500 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 70.070 - 2.200 |
| R-factor | 0.1741 |
| Rwork | 0.171 |
| R-free | 0.22610 |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.767 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | SOLVE |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 70.070 | 70.070 | 2.300 |
| High resolution limit [Å] | 2.200 | 10.000 | 2.200 |
| Rmerge | 0.077 | 0.071 | 0.294 |
| Rmeas | 0.079 | 0.075 | 0.305 |
| Total number of observations | 670570 | ||
| Number of reflections | 45946 | 546 | 5622 |
| <I/σ(I)> | 21.09 | 31.88 | 9.38 |
| Completeness [%] | 100.0 | 96.8 | 100 |
| Redundancy | 14.595 | 10.974 | 14.815 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 293 | 0.1M MES, 40% Polyethylene glycol 400, pH6.8 |
