7A26
Structure of soluble SmhA crystal form 1 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 I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-07-21 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 42 |
| Unit cell lengths | 151.364, 151.364, 133.456 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 67.692 - 2.980 |
| Rwork | 0.220 |
| R-free | 0.25390 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.627 |
| Data reduction software | DIALS |
| Data scaling software | DIALS |
| Phasing software | CRANK |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 67.692 | 3.030 |
| High resolution limit [Å] | 2.980 | 2.980 |
| Rmerge | 0.406 | 3.048 |
| Rpim | 0.078 | 0.575 |
| Number of reflections | 61518 | 3065 |
| <I/σ(I)> | 7.2 | |
| Completeness [%] | 100.0 | |
| Redundancy | 28.1 | |
| CC(1/2) | 1.000 | 0.600 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 280 | 0.1 M MES pH 6.5, 0.16 M CaCl2 and 20 % PEG 6000 |
