5J54
The Structure and Mechanism of NOV1, a Resveratrol-Cleaving Dioxygenase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 4.2.2 |
Synchrotron site | ALS |
Beamline | 4.2.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-08-28 |
Detector | NOIR-1 |
Wavelength(s) | 1.000 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 93.569, 100.143, 145.600 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.840 - 1.890 |
R-factor | 0.1496 |
Rwork | 0.148 |
R-free | 0.18020 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5j53 |
RMSD bond length | 0.012 |
RMSD bond angle | 0.997 |
Data reduction software | XDS |
Data scaling software | Aimless |
Refinement software | PHENIX (dev_2276) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.940 |
High resolution limit [Å] | 1.890 | 1.890 |
Rmerge | 0.110 | 0.520 |
Number of reflections | 54816 | |
<I/σ(I)> | 10.4 | 1.34 |
Completeness [%] | 95.0 | 71.1 |
Redundancy | 5.6 | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | 0.16 M MgCl2, 0.08 M Tris pH 8.5, 18% (w/v) PEG 4000, and 20% glycerol |