1UFK
Crystal structure of TT0836
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44B2 |
| Synchrotron site | SPring-8 |
| Beamline | BL44B2 |
| Temperature [K] | 90 |
| Detector technology | CCD |
| Collection date | 2002-06-09 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.0000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 81.862, 76.000, 62.129 |
| Unit cell angles | 90.00, 130.32, 90.00 |
Refinement procedure
| Resolution | 47.800 - 1.900 |
| R-factor | 0.232 |
| Rwork | 0.232 |
| R-free | 0.25000 |
| Structure solution method | MAD |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.600 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | SHARP |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.970 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.040 | 0.294 |
| Number of reflections | 22573 | |
| <I/σ(I)> | 28.5 | 4.8 |
| Completeness [%] | 98.5 | 98 |
| Redundancy | 3.8 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 293 | 20mM MES, 700mM ammonium sulfate, 4%(v/v) dioxane, 160mM 1,6-hexanediol, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K |
