3X15
Dimeric Aquifex aeolicus cytochrome c555
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL38B1 |
Synchrotron site | SPring-8 |
Beamline | BL38B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-06-09 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 57.591, 54.464, 65.403 |
Unit cell angles | 90.00, 114.47, 90.00 |
Refinement procedure
Resolution | 33.121 - 1.600 |
R-factor | 0.15378 |
Rwork | 0.150 |
R-free | 0.21377 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2zxy |
RMSD bond length | 0.010 |
RMSD bond angle | 1.489 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.660 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.055 | 0.599 |
Number of reflections | 47953 | |
<I/σ(I)> | 24.794 | 2.019 |
Completeness [%] | 98.7 | 97.8 |
Redundancy | 3.7 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 277 | 0.2M ammonium sulfate, 0.1M Sodium cacodylate trihydrate, 30% PEG8000, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K |