3TUF
Structure of the SpoIIQ-SpoIIIAH pore forming complex.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-10-23 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9763 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 78.797, 111.088, 136.093 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.720 - 2.260 |
R-factor | 0.16858 |
Rwork | 0.165 |
R-free | 0.22581 |
RMSD bond length | 0.024 |
RMSD bond angle | 2.095 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXS |
Refinement software | REFMAC (5.6.0086) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.300 |
High resolution limit [Å] | 2.260 | 2.260 |
Rmerge | 0.083 | 0.410 |
Number of reflections | 23724 | |
<I/σ(I)> | 25.7 | 2.1 |
Completeness [%] | 83.0 | 32.1 |
Redundancy | 6.6 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 293 | 0.1 M sodium acetate,50% PEG 400, 0.5 mM spermidine, pH 4.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |