4PZ1
Crystal structure of a sHIP (UniProt Id: Q99XU0) mutant from Streptococcus pyogenes
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | MAX II BEAMLINE I911-2 |
| Synchrotron site | MAX II |
| Beamline | I911-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-12-12 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.03841 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 29.370, 33.280, 89.580 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.760 - 1.730 |
| R-factor | 0.17957 |
| Rwork | 0.178 |
| R-free | 0.21065 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4mer |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.295 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.760 | 1.820 |
| High resolution limit [Å] | 1.730 | 1.730 |
| Rmerge | 0.064 | |
| Number of reflections | 9571 | |
| Completeness [%] | 98.8 | 97.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 291 | 20% PEG 6000, 0.2 M calcium chloride, 0.1 M Tris, pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 291K |
