5BUK
Structure of flavin-dependent chlorinase Mpy16
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.1 |
Synchrotron site | ALS |
Beamline | 8.2.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-03-21 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 62.831, 73.276, 189.717 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.080 - 1.950 |
R-factor | 0.1725 |
Rwork | 0.170 |
R-free | 0.21210 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3e1t |
RMSD bond length | 0.007 |
RMSD bond angle | 1.036 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.7.1_743) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 1.980 |
High resolution limit [Å] | 1.950 | 1.950 |
Rmerge | 0.089 | |
Number of reflections | 64779 | |
<I/σ(I)> | 37.63 | 3 |
Completeness [%] | 100.0 | 99.8 |
Redundancy | 12 | 11.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277 | PEG4000 |