3N1H
Crystal Structure of StWhy2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X25 |
| Synchrotron site | NSLS |
| Beamline | X25 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-11-14 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.08 |
| Spacegroup name | F 4 3 2 |
| Unit cell lengths | 164.576, 164.576, 164.576 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.622 - 2.201 |
| R-factor | 0.206 |
| Rwork | 0.203 |
| R-free | 0.25080 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1l3a |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.414 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.280 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Number of reflections | 10208 | |
| <I/σ(I)> | 16.9 | 3.8 |
| Completeness [%] | 100.0 | 99.9 |
| Redundancy | 37.3 | 19.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 21% PEG1000, 0.1M MOPS, 0.4M NH4H2PO4, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
