5BOF
Crystal Structure of Staphylococcus aureus Enolase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-12-21 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 4 21 2 |
| Unit cell lengths | 164.686, 164.686, 77.335 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.450 |
| R-factor | 0.18763 |
| Rwork | 0.186 |
| R-free | 0.22861 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1e9i |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.286 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.540 |
| High resolution limit [Å] | 2.450 | 2.450 |
| Rmerge | 0.080 | 0.483 |
| Number of reflections | 39128 | |
| <I/σ(I)> | 29.2 | 4.5 |
| Completeness [%] | 98.3 | 99.4 |
| Redundancy | 7.3 | 8.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 289 | 0.01 M Cobalt (II) chloride, 0.1 M MES pH 6.5, 1.8 M Ammonium sulfate |
