5KE1
Structure of a C-terminal fragment of the IcsA/VirG passenger-domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-05-27 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9184 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 35.870, 84.670, 114.270 |
Unit cell angles | 90.00, 98.46, 90.00 |
Refinement procedure
Resolution | 42.335 - 1.900 |
R-factor | 0.1679 |
Rwork | 0.166 |
R-free | 0.19500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ml3 |
RMSD bond length | 0.005 |
RMSD bond angle | 0.693 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.10_2155) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 42.335 | 2.000 | |
High resolution limit [Å] | 1.900 | 10.000 | 1.900 |
Rmerge | 0.091 | 0.026 | 0.817 |
Number of reflections | 52462 | ||
<I/σ(I)> | 13.11 | 42 | 2.5 |
Completeness [%] | 98.4 | 98.2 | 97.6 |
Redundancy | 6.8 | ||
CC(1/2) | 0.999 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.2 | 293 | 0.2 M KCl, 0.1 M TRIS pH 7.2, 26% Jeffamine M-2070 |