6JUB
Radiation damage in Aspergillus oryzae pro-tyrosinase oxygen-bound C92A mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-06-04 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 0.900 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 53.858, 117.941, 78.324 |
Unit cell angles | 90.00, 91.35, 90.00 |
Refinement procedure
Resolution | 30.000 - 1.540 |
R-factor | 0.1747 |
Rwork | 0.155 |
R-free | 0.23370 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3w6w |
RMSD bond length | 0.005 |
RMSD bond angle | 0.017 |
Data reduction software | DENZO |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | SHELXL (2017/1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.570 |
High resolution limit [Å] | 1.540 | 1.540 |
Rmerge | 0.081 | 0.710 |
Number of reflections | 142480 | 7156 |
<I/σ(I)> | 24.3 | 2 |
Completeness [%] | 99.1 | 100 |
Redundancy | 3.7 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 293 | 18% polyethylene glycol (PEG) 3350, 30mM NH4NO3 |