3C8G
Crystal structure of a possible transciptional regulator YggD from Shigella flexneri 2a str. 2457T
Replaces: 2HKTExperimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-03-29 |
| Detector | SBC-3 |
| Wavelength(s) | 0.97883 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 71.365, 70.946, 159.037 |
| Unit cell angles | 90.00, 90.43, 90.00 |
Refinement procedure
| Resolution | 31.810 - 2.500 |
| R-factor | 0.21163 |
| Rwork | 0.207 |
| R-free | 0.27034 |
| Structure solution method | SAD |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.721 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | SHELXD |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 32.000 | 2.590 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.074 | 0.520 |
| Number of reflections | 26162 | |
| <I/σ(I)> | 30.78 | 1.88 |
| Completeness [%] | 94.2 | 78.9 |
| Redundancy | 4 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 30% (w/v) PEG MME 2000, 0.1M Sodium acetate, 0.1M MES, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
