4YYW
Ficin D2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-03-12 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9801 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 71.017, 52.414, 64.364 |
| Unit cell angles | 90.00, 101.34, 90.00 |
Refinement procedure
| Resolution | 36.964 - 1.446 |
| R-factor | 0.1702 |
| Rwork | 0.169 |
| R-free | 0.19700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4yyr |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.289 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.6.1_357)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.964 | 1.500 |
| High resolution limit [Å] | 1.446 | 1.450 |
| Rmerge | 0.098 | 0.373 |
| Number of reflections | 38225 | |
| <I/σ(I)> | 11.1 | 3.4 |
| Completeness [%] | 91.9 | 72 |
| Redundancy | 4.7 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 2.0 M (NH4)2SO4, 0.1 M Na-Acetate pH 4.6 |
