4Z3B
Crystal structure of MnCO/apo-R52CFr
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | SPRING-8 BEAMLINE BL38B1 |
Synchrotron site | SPring-8 |
Beamline | BL38B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-06-25 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 1.00 |
Spacegroup name | F 4 3 2 |
Unit cell lengths | 181.733, 181.733, 181.733 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 27.710 - 1.420 |
R-factor | 0.16682 |
Rwork | 0.166 |
R-free | 0.17650 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1dat |
RMSD bond length | 0.031 |
RMSD bond angle | 2.815 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 27.710 | 1.440 |
High resolution limit [Å] | 1.420 | 1.420 |
Rmerge | 0.071 | |
Number of reflections | 48815 | |
<I/σ(I)> | 60.7 | 60.7 |
Completeness [%] | 99.8 | 99.78 |
Redundancy | 20.6 | 11 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 1M ammonium sulfate, 20mM cadmium sulfite |