5GJ7
putative Acyl-CoA dehydrogenase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 7A (6B, 6C1) |
Synchrotron site | PAL/PLS |
Beamline | 7A (6B, 6C1) |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-10-19 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 155.691, 69.384, 83.255 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.950 |
R-factor | 0.1978 |
Rwork | 0.196 |
R-free | 0.22350 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.016 |
RMSD bond angle | 1.667 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 20.000 | 20.000 | 1.980 |
High resolution limit [Å] | 1.950 | 5.260 | 1.950 |
Rmerge | 0.094 | 0.058 | 0.595 |
Number of reflections | 65742 | ||
<I/σ(I)> | 12.8 | ||
Completeness [%] | 99.6 | 93.4 | 100 |
Redundancy | 6.7 | 6.2 | 6.6 |
CC(1/2) | 0.996 | 0.948 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 300 | 0.2M magnesium Chloride 0.1M MES :NaOH pH6.5 10%(w/v) PEG 4000 |