8OWU
The crystal structure of the polymorphic toxin PT7(Bc) D37A mutant and its cognate immunity PIM7(Bc) complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID30B |
Synchrotron site | ESRF |
Beamline | ID30B |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-04-10 |
Detector | DECTRIS EIGER2 X 9M |
Wavelength(s) | 0.96546 |
Spacegroup name | P 1 |
Unit cell lengths | 36.607, 51.912, 54.520 |
Unit cell angles | 94.69, 91.36, 101.67 |
Refinement procedure
Resolution | 50.640 - 2.540 |
R-factor | 0.2167 |
Rwork | 0.214 |
R-free | 0.26360 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.443 |
Data reduction software | autoPROC |
Data scaling software | autoPROC |
Phasing software | PHASER |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.640 | 2.580 |
High resolution limit [Å] | 2.540 | 2.540 |
Number of reflections | 12467 | 1153 |
<I/σ(I)> | 6.6 | |
Completeness [%] | 96.4 | |
Redundancy | 1.4 | |
CC(1/2) | 0.970 | 0.960 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 12% PEG-20000, 0.1 M MES pH 6.5. |