5I3T
Native Structure of the Linalool Dehydratase-Isomerase from Castellaniella defragrans
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-07-07 |
Detector | RAYONIX MX300-HS |
Wavelength(s) | 0.98 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 102.957, 106.757, 188.872 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.193 - 2.100 |
R-factor | 0.164 |
Rwork | 0.163 |
R-free | 0.20450 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.078 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 30.193 |
High resolution limit [Å] | 2.090 |
Number of reflections | 234053 |
<I/σ(I)> | 5.68 |
Completeness [%] | 99.7 |
Redundancy | 20 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | BATCH MODE | 8 | 291 | 4-7% glycerol, 20-30% PEG 4000, 0.1 M TRIS pH 8.0 |