4ONJ
Crystal structure of the catalytic domain of ntDRM
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-06-04 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9792 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 153.324, 153.324, 148.967 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.510 - 2.807 |
R-factor | 0.2016 |
Rwork | 0.201 |
R-free | 0.22070 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.288 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.900 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.122 | 0.723 |
Number of reflections | 52015 | |
<I/σ(I)> | 24.2 | 2.6 |
Completeness [%] | 99.9 | 100 |
Redundancy | 7 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.19 M calcium chloride, 5% glycerol, 26.6% PEG400, 0.095 M HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |