3VGZ
Crystal structure of E. coli YncE
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL26B2 |
| Synchrotron site | SPring-8 |
| Beamline | BL26B2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-11-29 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97902, 0.97944, 1.00000 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 119.170, 139.310, 173.690 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.700 |
| R-factor | 0.22 |
| Rwork | 0.220 |
| R-free | 0.24400 |
| Structure solution method | MAD |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.410 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SHELXD |
| Refinement software | CNS (1.21) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.760 |
| High resolution limit [Å] | 1.700 | 3.660 | 1.700 |
| Number of reflections | 157493 | ||
| <I/σ(I)> | 12.6 | 43.7 | 5.9 |
| Completeness [%] | 99.9 | 99.4 | 100 |
| Redundancy | 7.1 | 6.5 | 7.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.4 | 293 | sodium acetate, ammonium sulfate, PEG 4000, pH 4.4, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
