4ZCN
Crystal structure of nvPizza2-S16S58
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-17A |
| Synchrotron site | Photon Factory |
| Beamline | BL-17A |
| Temperature [K] | 95 |
| Detector technology | CCD |
| Collection date | 2014-06-11 |
| Detector | ADSC QUANTUM 270 |
| Wavelength(s) | 0.98000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 31.582, 70.368, 43.738 |
| Unit cell angles | 90.00, 107.14, 90.00 |
Refinement procedure
| Resolution | 41.796 - 1.300 |
| R-factor | 0.1505 |
| Rwork | 0.149 |
| R-free | 0.18270 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ww7 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.122 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (dev_1839) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.320 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmerge | 0.078 | 0.315 |
| Number of reflections | 44607 | |
| <I/σ(I)> | 29.4 | 5.6 |
| Completeness [%] | 98.6 | 97 |
| Redundancy | 3.8 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 2.2 M ammonium sulfate and 0.6 M potassium iodide |
