7D8L
The structure of nucleoside phosphatase Sa1684 complex with GTP analogue from Staphylococcus aureus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2017-01-18 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9875 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.968, 35.907, 59.460 |
| Unit cell angles | 90.00, 111.71, 90.00 |
Refinement procedure
| Resolution | 45.540 - 1.550 |
| R-factor | 0.2184 |
| Rwork | 0.217 |
| R-free | 0.25270 |
| Structure solution method | SAD |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.650 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.580 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.079 | |
| Number of reflections | 28764 | 1401 |
| <I/σ(I)> | 21.53 | |
| Completeness [%] | 98.7 | |
| Redundancy | 4.4 | |
| CC(1/2) | 0.888 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 289.15 | 20% PEG400, 0.1M sodium citrate pH 5.5 |
