4W7H
Crystal Structure of DEH Reductase A1-R Mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL38B1 |
Synchrotron site | SPring-8 |
Beamline | BL38B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-07-18 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.000 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 104.500, 104.500, 68.116 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 50.000 - 3.110 |
R-factor | 0.20177 |
Rwork | 0.197 |
R-free | 0.29465 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3afm |
RMSD bond length | 0.006 |
RMSD bond angle | 1.025 |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 3.110 |
Number of reflections | 7885 |
<I/σ(I)> | 67.5 |
Completeness [%] | 99.5 |
Redundancy | 11.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 8.5 | 293 | PEG 4000, Lithium chloride, tris (hydroxymethyl) aminomethane |