8BEZ
Structure of the Lysinibacillus sphaericus Tpp49Aa1 pesticidal protein at pH 11
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | FREE ELECTRON LASER |
Source details | EUROPEAN XFEL BEAMLINE SPB/SFX |
Synchrotron site | European XFEL |
Beamline | SPB/SFX |
Temperature [K] | 298 |
Detector technology | PIXEL |
Collection date | 2022-04-22 |
Detector | AGIPD |
Wavelength(s) | 1.33 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 80.120, 83.220, 156.490 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.120 - 1.750 |
R-factor | 0.1777 |
Rwork | 0.176 |
R-free | 0.19940 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3wa1 5foy 5g37 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.443 |
Data reduction software | CrystFEL |
Data scaling software | CrystFEL (Ambigator) |
Phasing software | PHASER (2.8.3) |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 36.120 | 1.770 |
High resolution limit [Å] | 1.750 | 1.750 |
Number of reflections | 105904 | 6782 |
<I/σ(I)> | 14.81 | |
Completeness [%] | 99.8 | |
Redundancy | 323.7 | |
CC(1/2) | 0.998 | 0.249 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | IN CELL | 11 | 298 | Natural |