4YNR
DosS GAFA Domain Reduced CO Bound Crystal Structure
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-11-13 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.115867 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 33.505, 79.247, 109.451 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.010 - 1.920 |
| R-factor | 0.192 |
| Rwork | 0.189 |
| R-free | 0.23500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.295 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE: 1.9_1692)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.030 |
| High resolution limit [Å] | 1.916 | 1.920 |
| Rmerge | 0.062 | 0.749 |
| Number of reflections | 22480 | |
| <I/σ(I)> | 17.77 | 1.7 |
| Completeness [%] | 96.8 | 85.4 |
| Redundancy | 3.8 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7 | 298 | 0.1M Tris-HCl, 15-18% PEG 4000, 0.2M calcium acetate |
