4OJ1
Crystal structure of truncated Acylphosphatase from S. sulfataricus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2013-04-05 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.0716 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 41.150, 41.330, 91.400 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 24.580 - 1.700 |
| R-factor | 0.16939 |
| Rwork | 0.167 |
| R-free | 0.21968 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4oix |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.422 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.580 | 1.790 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.129 | 0.404 |
| Number of reflections | 17297 | |
| <I/σ(I)> | 11.4 | 4.4 |
| Completeness [%] | 97.1 | 91.2 |
| Redundancy | 5.3 | 5.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | 2.0 M NaCl, 10% PEG 6000, pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
