8I6Z
Crystal structure of apo-form of malonyl-CoA reductase C-domain from Chloroflexus aurantiacus
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 | 2016-09-26 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.97934 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 85.788, 140.355, 73.859 |
Unit cell angles | 90.00, 97.74, 90.00 |
Refinement procedure
Resolution | 26.670 - 1.950 |
R-factor | 0.15806 |
Rwork | 0.156 |
R-free | 0.18810 |
Structure solution method | SAD |
RMSD bond length | 0.012 |
RMSD bond angle | 1.679 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SOLVE |
Refinement software | REFMAC (v5.8.0267) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.980 |
High resolution limit [Å] | 1.950 | 5.290 | 1.950 |
Rmerge | 0.069 | 0.039 | 0.266 |
Total number of observations | 258517 | ||
Number of reflections | 62767 | 5963 | 5844 |
<I/σ(I)> | 13.9 | ||
Completeness [%] | 99.5 | 96 | 95.6 |
Redundancy | 2.1 | 2 | 1.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293.15 | 0.1 M ammonium tartrate, 0.1 M Tris-Cl |