3IPO
Crystal structure of YnjE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-07-02 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.8 |
| Spacegroup name | P 63 2 2 |
| Unit cell lengths | 160.949, 160.949, 173.992 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 40.996 - 2.400 |
| R-factor | 0.16121 |
| Rwork | 0.159 |
| R-free | 0.21112 |
| Structure solution method | SAD |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.601 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.2.21) |
| Phasing software | SHARP |
| Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.996 | 2.530 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.112 | 0.551 |
| Number of reflections | 52432 | |
| <I/σ(I)> | 25.7 | 6.4 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 21.8 | 21.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 298 | 17-21% PEG 4000, 0.1 M sodium phosphate citrate, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
