3WEV
Crystal structure of the Schiff base intermediate of L-Lys epsilon-oxidase from Marinomonas mediterranea with L-Lys
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-17A |
Synchrotron site | Photon Factory |
Beamline | BL-17A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-05-30 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.98 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 194.992, 126.164, 70.865 |
Unit cell angles | 90.00, 99.03, 90.00 |
Refinement procedure
Resolution | 46.860 - 1.980 |
R-factor | 0.15187 |
Rwork | 0.150 |
R-free | 0.18914 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3weu |
RMSD bond length | 0.019 |
RMSD bond angle | 1.838 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.020 |
High resolution limit [Å] | 1.980 | 1.990 |
Rmerge | 0.097 | 0.362 |
Number of reflections | 115096 | |
<I/σ(I)> | 29.1 | 7 |
Completeness [%] | 99.2 | 97.2 |
Redundancy | 5.8 | 5.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 1.6M ammonium sulfate, 10%(v/v) 1,4-dioxane, 0.1M MES/NaOH, 75mM L-Lys, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |