4IAL
Crystal structure of Staphylococcal nuclease variant Delta+PHS H121E at cryogenic temperature
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X25 |
| Synchrotron site | NSLS |
| Beamline | X25 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-09-26 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.10 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 31.030, 60.395, 38.387 |
| Unit cell angles | 90.00, 92.32, 90.00 |
Refinement procedure
| Resolution | 38.355 - 1.595 |
| R-factor | 0.1989 |
| Rwork | 0.197 |
| R-free | 0.23890 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3bdc |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.908 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (2.3.0) |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 38.355 | 38.355 | 1.630 |
| High resolution limit [Å] | 1.595 | 4.340 | 1.595 |
| Rmerge | 0.051 | 0.043 | 0.261 |
| Number of reflections | 18439 | ||
| <I/σ(I)> | 38.332 | 4.01 | |
| Completeness [%] | 97.7 | 98 | 85.9 |
| Redundancy | 3.7 | 3.7 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 277 | 24% MPD, 25 mM potassium phosphate, calcium chloride, pdTp, pH 8, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
