6SSV
The structure of serpin from Schistosoma mansoni
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 | 2018-12-03 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9686 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 98.887, 98.887, 115.338 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 47.840 - 3.220 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3sto |
| Data reduction software | xia2 |
| Data scaling software | pointless |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.840 | 3.270 |
| High resolution limit [Å] | 3.220 | 3.220 |
| Number of reflections | 10945 | 504 |
| <I/σ(I)> | 5.1 | |
| Completeness [%] | 99.8 | |
| Redundancy | 9.5 | |
| CC(1/2) | 0.966 | 0.361 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | 10% w/v PEG 20000, 20% v/v PEG MME 550, 0.03 M Morpheus Ethylene Glycols, 0.1 M MOPS/HEPES-Na (CONDITION E5 OF MORPHEUS SCREEN FROM MOLECULAR DIMENSIONS) |
