4GUX
Crystal structure of trypsin:MCoTi-II complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-11-01 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 0.953645 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 136.139, 71.852, 108.460 |
| Unit cell angles | 90.00, 119.76, 90.00 |
Refinement procedure
| Resolution | 31.690 - 1.803 |
| R-factor | 0.1615 |
| Rwork | 0.157 |
| R-free | 0.19410 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2uuy |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.022 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.7_650)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 31.690 | 1.830 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.449 | |
| Number of reflections | 82545 | |
| Completeness [%] | 99.9 | 97.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 28% PEG3350, 0.24M ammonium acetate, 0.1M BisTris, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
