8F90
Intramolecular ester bond-containing repeat domain 2 from Suipraoptans intestinalis adhesin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-08-21 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.953739 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 82.075, 90.603, 89.686 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.301 - 1.600 |
Rwork | 0.157 |
R-free | 0.19810 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 1.279 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.301 | 1.490 |
High resolution limit [Å] | 1.460 | 1.460 |
Number of reflections | 114397 | 5159 |
<I/σ(I)> | 10.6 | 1 |
Completeness [%] | 99.6 | 92.2 |
Redundancy | 13.6 | 12.1 |
CC(1/2) | 0.999 | 0.211 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.2 M MgCl2, 0.1 M Bis-Tris, 25% PEG 3350 |