4C5O
Flavin monooxygenase from Stenotrophomonas maltophilia. Q193R H194T mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 120 |
Detector technology | CCD |
Collection date | 2012-07-07 |
Detector | ADSC QUANTUM 315 |
Spacegroup name | P 32 |
Unit cell lengths | 170.538, 170.538, 101.762 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 147.690 - 2.600 |
R-factor | 0.257 |
Rwork | 0.255 |
R-free | 0.29496 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4a9w |
RMSD bond length | 0.013 |
RMSD bond angle | 1.656 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0033) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 59.780 | 2.650 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.150 | 0.560 |
Number of reflections | 102301 | |
<I/σ(I)> | 4.6 | 2.1 |
Completeness [%] | 97.8 | 99.4 |
Redundancy | 4.8 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.6 | THE RESERVOIR CONTAINED 0.9 M LITHIUM SULPHATE IN 100 MM BIS-TRIS PROPANE BUFFER (PH 5.6). THE PROTEIN CONCENTRATION USED WAS 3 MG ML-1. |