5YIG
Crystal structure of Streptococcus pneumonia ParE with inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-10-17 |
| Detector | RIGAKU AFC-5R |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 43.394, 61.980, 84.824 |
| Unit cell angles | 90.00, 99.03, 90.00 |
Refinement procedure
| Resolution | 35.934 - 2.800 |
| R-factor | 0.2108 |
| Rwork | 0.206 |
| R-free | 0.25520 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.991 |
| Data scaling software | SAINT (V8.34A) |
| Phasing software | PHASER (2.5.6) |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.934 | 2.865 |
| High resolution limit [Å] | 2.800 | 1.800 |
| Rmerge | 0.179 | |
| Number of reflections | 21230 | |
| <I/σ(I)> | 5.72 | |
| Completeness [%] | 99.5 | |
| Redundancy | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.2M Sodium Acetate, 18-22% PEG 3350 |
