7D6P
X-ray structure of the intermolecular complex of Clostridium perfringens sortase C with the C-terminal cell wall sorting signal motif.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2019-12-26 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 104.210, 104.210, 44.870 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 18.800 - 2.380 |
Rwork | 0.244 |
R-free | 0.27630 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6ixz |
RMSD bond length | 0.007 |
RMSD bond angle | 1.500 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 18.800 | 2.440 |
High resolution limit [Å] | 2.380 | 2.380 |
Number of reflections | 11342 | 825 |
<I/σ(I)> | 11.7 | |
Completeness [%] | 98.6 | |
Redundancy | 10.5 | |
CC(1/2) | 0.997 | 0.909 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | 25% (w/v) PEG 3350, 200mM LiSO4, 100mM Tris-HCl, pH 8.5 |