3GT4
Structure of proteinase K with the magic triangle I3C
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 106 |
| Detector technology | CCD |
| Collection date | 2008-12-01 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.54178 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 67.784, 67.784, 101.845 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.900 - 1.760 |
| R-factor | 0.14 |
| Rwork | 0.140 |
| R-free | 0.19100 |
| Structure solution method | SAD |
| Starting model (for MR) | none |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.023 |
| Data reduction software | XDS |
| Data scaling software | SADABS |
| Phasing software | SHELXD |
| Refinement software | SHELX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.900 | 1.860 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Rmerge | 0.048 | 0.130 |
| Number of reflections | 22828 | |
| <I/σ(I)> | 33.8 | 8.3 |
| Completeness [%] | 93.8 | 62 |
| Redundancy | 10.14 | 1.73 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.2 | 293 | 0.1M TRIS, 1.28M ammonium sulfate, pH 7.2, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
