6FQ4
Structure of Chlamydial virulence factor TarP and vinculin head domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-12-10 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.97623 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 51.807, 66.873, 95.832 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 95.830 - 2.890 |
R-factor | 0.28944 |
Rwork | 0.286 |
R-free | 0.34593 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3zdl |
RMSD bond length | 0.010 |
RMSD bond angle | 1.430 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 95.830 | 3.050 |
High resolution limit [Å] | 2.890 | 2.890 |
Rmerge | 0.156 | 0.806 |
Rmeas | 0.171 | 0.882 |
Rpim | 0.070 | 0.355 |
Number of reflections | 7888 | 1131 |
<I/σ(I)> | 8.1 | 2.5 |
Completeness [%] | 99.8 | 99.9 |
Redundancy | 6.1 | 6.3 |
CC(1/2) | 0.994 | 0.903 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 294 | 0.1 M sodium citrate tribasic dehydrate pH 5.6, 20% 2-propanol |