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 |