3HIC
THE CRYSTAL STRUCTURE OF PHOSPHOFRUCTOKINASE(Lin2199)FROM Listeria innocua
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X12C |
| Synchrotron site | NSLS |
| Beamline | X12C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-05-01 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.9795 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 89.196, 44.598, 88.242 |
| Unit cell angles | 90.00, 113.47, 90.00 |
Refinement procedure
| Resolution | 40.910 - 2.020 |
| R-factor | 0.217 |
| Rwork | 0.217 |
| R-free | 0.24800 |
| Structure solution method | SAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.300 |
| Data reduction software | DENZO |
| Data scaling software | HKL-2000 |
| Phasing software | SHELXCD |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.090 |
| High resolution limit [Å] | 2.020 | 2.020 |
| Rmerge | 0.084 | 0.450 |
| Number of reflections | 21120 | |
| <I/σ(I)> | 9.9 | 4.5 |
| Completeness [%] | 99.7 | 92.1 |
| Redundancy | 7.1 | 5.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 292 | 1M Bis-Tris pH 6.5 [100mM]+ 50% PEG 3350 [25%] + Lithium Sulfate [200mM], VAPOR DIFFUSION, SITTING DROP, temperature 292K |
