5KWM
S. erythraea trypsin long construct apoenzyme
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-03-09 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.8266 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 46.851, 61.122, 74.151 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.164 - 0.777 |
| R-factor | 0.1294 |
| Rwork | 0.129 |
| R-free | 0.13720 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4m7g |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.063 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((dev_2471: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 0.790 |
| High resolution limit [Å] | 0.777 | 0.777 |
| Rmerge | 0.057 | 0.071 |
| Number of reflections | 197513 | |
| <I/σ(I)> | 15.6 | 0.6 |
| Completeness [%] | 74.1 | 6.4 |
| Redundancy | 6.5 | 2.1 |
| CC(1/2) | 0.997 | 0.985 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.1 | 311 | 100 mM HEPES, pH 8.1, 2.31 M ammonium sulfate |
