8GBT
Time-resolve SFX structure of a photoproduct of carbon monoxide complex of bovine cytochrome c oxidase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | FREE ELECTRON LASER |
Source details | SLAC LCLS BEAMLINE CXI |
Synchrotron site | SLAC LCLS |
Beamline | CXI |
Temperature [K] | 293 |
Detector technology | PIXEL |
Collection date | 2016-06-16 |
Detector | CS-PAD CXI-1 |
Wavelength(s) | 1.321 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 178.300, 189.000, 209.000 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 32.002 - 2.800 |
Rwork | 0.223 |
R-free | 0.26870 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.553 |
Data reduction software | CrystFEL |
Data scaling software | CrystFEL |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.450 | 2.990 |
High resolution limit [Å] | 1.759 | 2.870 |
Number of reflections | 172414 | 17697 |
<I/σ(I)> | 6.92 | |
Completeness [%] | 100.0 | 100 |
Redundancy | 6.9 | |
CC(1/2) | 0.859 | 0.226 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | BATCH MODE | 6.8 | 277 | PEG4000, Sodium Phosphate, decylmaltoside |