4ARJ
Crystal structure of a pesticin (translocation and receptor binding domain) from Y. pestis and T4-lysozyme chimera
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 194.874, 51.507, 107.921 |
| Unit cell angles | 90.00, 91.01, 90.00 |
Refinement procedure
| Resolution | 72.955 - 2.593 |
| R-factor | 0.194 |
| Rwork | 0.192 |
| R-free | 0.23670 |
| Structure solution method | MIR |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.483 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 73.000 | 2.660 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.080 | 0.480 |
| Number of reflections | 33200 | |
| <I/σ(I)> | 7.8 | 1.8 |
| Completeness [%] | 95.2 | 91.8 |
| Redundancy | 2.1 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 20% PEG 3350 0.15 M K2(SO4), pH 7 |
