5Z50
Crystal structure of PaCysB regulatory domain
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-10-13 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.9725 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 65.718, 65.718, 259.380 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.390 - 2.206 |
| R-factor | 0.2208 |
| Rwork | 0.219 |
| R-free | 0.24990 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ixc |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.949 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.280 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.523 | |
| Number of reflections | 29819 | |
| <I/σ(I)> | 18.75 | |
| Completeness [%] | 99.8 | 99.4 |
| Redundancy | 16.7 | 8.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291.15 | 0.1M MES PH 6.6, 1.6M Ammonium sulfate ,10% 1,4-Dioxane |
