4GJ4
The Crystal Structure of the soluble Guanylate Cyclase PAS alpha domain from Manduca sexta
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL7-1 |
| Synchrotron site | SSRL |
| Beamline | BL7-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-05-07 |
| Detector | MARMOSAIC 325 mm CCD |
| Wavelength(s) | 0.97950 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 95.424, 95.424, 317.693 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 23.150 - 1.800 |
| R-factor | 0.19845 |
| Rwork | 0.196 |
| R-free | 0.24170 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2p04 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.548 |
| Data reduction software | CrystalClear |
| Data scaling software | CrystalClear |
| Phasing software | MrBUMP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 23.700 | 1.860 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.055 | 0.691 |
| Number of reflections | 52047 | |
| <I/σ(I)> | 11.3 | 1.9 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 8.75 | 8.56 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.4 | 277 | 1.5 M Lithium Sulfate, 0.1 M Hepes, pH 7.4, VAPOR DIFFUSION, SITTING DROP, temperature 277.0K |
