6EI4
Crystal Structure of tyrosinase from Bacillus megaterium with B5N inhibitor in the active site
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-05-20 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 1.072 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 53.650, 78.100, 81.050 |
Unit cell angles | 90.00, 104.52, 90.00 |
Refinement procedure
Resolution | 28.098 - 2.000 |
Rwork | 0.227 |
R-free | 0.25050 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4p6r |
RMSD bond length | 0.005 |
RMSD bond angle | 0.901 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.100 | 1.800 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.128 | 0.484 |
Number of reflections | 71968 | 375111 |
<I/σ(I)> | 6.5 | 3.1 |
Completeness [%] | 98.8 | 98.4 |
Redundancy | 5.2 | 5.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 18% PEG 8000 0.1M sodium cacodylate |