8P6K
Structure of the hypervariable region of Streptococcus pyogenes M3 protein
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-05-05 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.969 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 150.474, 24.107, 78.007 |
Unit cell angles | 90.00, 105.29, 90.00 |
Refinement procedure
Resolution | 75.247 - 1.918 |
Rwork | 0.230 |
R-free | 0.26790 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.440 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 75.250 | 1.950 |
High resolution limit [Å] | 1.918 | 1.920 |
Rmeas | 0.058 | 1.741 |
Number of reflections | 21415 | 1045 |
<I/σ(I)> | 14.8 | |
Completeness [%] | 99.7 | |
Redundancy | 6.2 | |
CC(1/2) | 0.900 | 0.500 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 40% MPD |