3UOX
Crystal Structure of OTEMO (FAD bound form 2)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-12-18 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 0.9793 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 67.318, 92.540, 93.350 |
Unit cell angles | 90.00, 103.27, 90.00 |
Refinement procedure
Resolution | 48.156 - 1.956 |
R-factor | 0.1922 |
Rwork | 0.190 |
R-free | 0.23040 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3uov |
RMSD bond length | 0.015 |
RMSD bond angle | 1.512 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 90.857 | 90.857 | 2.020 |
High resolution limit [Å] | 1.956 | 4.200 | 1.956 |
Rmerge | 0.098 | 0.038 | 0.541 |
Number of reflections | 79134 | ||
<I/σ(I)> | 8.9 | ||
Completeness [%] | 99.0 | 96.7 | 98.4 |
Redundancy | 3.1 | 3.3 | 2.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 295 | 22% PEG3350, 0.1 M sodium/potassium phosphate, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K |