5XOE
Crystal Structure of the apo Staphylococcus aureus phosphofructokinase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-06-08 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97915 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 116.230, 36.949, 87.810 |
| Unit cell angles | 90.00, 123.30, 90.00 |
Refinement procedure
| Resolution | 73.390 - 2.980 |
| R-factor | 0.23646 |
| Rwork | 0.233 |
| R-free | 0.31104 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3u39 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.612 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 73.390 | 3.050 |
| High resolution limit [Å] | 2.980 | 3.000 |
| Rmerge | 0.105 | 0.474 |
| Number of reflections | 6551 | 340 |
| <I/σ(I)> | 10.5 | 2.4 |
| Completeness [%] | 99.5 | 98.6 |
| Redundancy | 4.6 | 4.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289 | 15% PEG 4000, 0.1M MES PH 6.0, 0.15M (NH4)2SO4 |
