8GL3
De novo design of monomeric helical bundles for pH-controlled membrane lysis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.2 |
Synchrotron site | ALS |
Beamline | 8.2.2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-11-04 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.99998 |
Spacegroup name | I 1 2 1 |
Unit cell lengths | 32.120, 44.703, 182.579 |
Unit cell angles | 90.00, 90.43, 90.00 |
Refinement procedure
Resolution | 45.640 - 2.300 |
R-factor | 0.2404 |
Rwork | 0.238 |
R-free | 0.28360 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.002 |
RMSD bond angle | 0.337 |
Data reduction software | DIALS |
Data scaling software | DIALS |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.640 | 2.530 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.082 | 0.144 |
Rpim | 0.052 | 0.091 |
Number of reflections | 11502 | 2812 |
<I/σ(I)> | 10.5 | 7.39 |
Completeness [%] | 98.4 | 98.13 |
Redundancy | 3.3 | 3.4 |
CC(1/2) | 0.998 | 0.976 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | 0.2 M Sodium fluoride and 20% (w/v) PEG 3350 |