8CPK
Crystal structure of EtpA secretion domain from Enterotoxigenic Escherichia coli
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-01-31 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.0000 |
Spacegroup name | P 1 |
Unit cell lengths | 37.711, 64.188, 123.957 |
Unit cell angles | 91.61, 90.89, 90.02 |
Refinement procedure
Resolution | 61.950 - 1.760 |
R-factor | 0.2021 |
Rwork | 0.200 |
R-free | 0.24010 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 0.799 |
Data reduction software | xia2 |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 64.162 | 1.790 |
High resolution limit [Å] | 1.760 | 1.760 |
Number of reflections | 112100 | 5450 |
<I/σ(I)> | 8.3 | |
Completeness [%] | 97.0 | |
Redundancy | 3.4 | |
CC(1/2) | 0.999 | 0.297 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 285 | 0.1 M Na2 citrate pH 5.5, 20% (w/v) PEG 4000, 20% (v/v) isopropanol |