2FOR
Crystal Structure of the Shigella flexneri Farnesyl Pyrophosphate Synthase Complex with an Isopentenyl Pyrophosphate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 5ID-B |
| Synchrotron site | APS |
| Beamline | 5ID-B |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-10-30 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.000000 |
| Spacegroup name | P 61 |
| Unit cell lengths | 75.664, 75.664, 216.660 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 65.510 - 2.000 |
| R-factor | 0.18369 |
| Rwork | 0.181 |
| R-free | 0.23290 |
| Structure solution method | SAD |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.445 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | SHARP |
| Refinement software | REFMAC (5.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 65.510 | 2.120 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.020 | 0.235 |
| Number of reflections | 45940 | |
| <I/σ(I)> | 57.66 | 7.5 |
| Completeness [%] | 97.3 | 87.8 |
| Redundancy | 6.5 | 5.37 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 295 | 0.1M HEPES sodium salt, 0.4M Sodium phosphate, 0.4M Potassium phosphate, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
