4NSM
crystal structure of the streptococcal collagen-like protein 2 globular domain from invasive M3-type group A Streptococcus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-03-12 |
Detector | RIGAKU SATURN 944 |
Wavelength(s) | 1.54 |
Spacegroup name | H 3 2 |
Unit cell lengths | 44.405, 44.405, 227.767 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 14.980 - 1.600 |
R-factor | 0.19854 |
Rwork | 0.195 |
R-free | 0.23995 |
Structure solution method | SAD |
RMSD bond length | 0.026 |
RMSD bond angle | 2.059 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXS |
Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.550 |
High resolution limit [Å] | 1.520 | 1.520 |
Rmerge | 0.061 | 0.345 |
Number of reflections | 13802 | |
Completeness [%] | 99.2 | 86.7 |
Redundancy | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 6.5 | 298 | 0.05M Ammonium sulfate, 0.05M BIS-TRIS pH 6.5, 30% v/v Pentaerythritol ethoxylate (15/4 EO/OH), EVAPORATION, temperature 298K |