7A0G
Structure of the SmhB pore of the tripartite alpha-pore forming toxin, Smh, from Serratia marcescens.
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2018-09-23 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 224.481, 118.062, 209.532 |
Unit cell angles | 90.00, 109.44, 90.00 |
Refinement procedure
Resolution | 66.769 - 6.979 |
Rwork | 0.334 |
R-free | 0.33510 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6grj |
RMSD bond length | 0.005 |
RMSD bond angle | 1.496 |
Data reduction software | DIALS |
Data scaling software | DIALS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 66.769 | 7.100 |
High resolution limit [Å] | 6.979 | 6.979 |
Rmerge | 2.295 | 3.384 |
Rpim | 1.403 | 2.356 |
Number of reflections | 8304 | 350 |
<I/σ(I)> | 1.3 | |
Completeness [%] | 98.8 | |
Redundancy | 3.5 | |
CC(1/2) | 0.700 | 0.500 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 280.15 | 0.2M Calcium chloride, 40% MPD |