4X5M
Crystal structure of SemiSWEET in the inward-open conformation
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL32XU |
Synchrotron site | SPring-8 |
Beamline | BL32XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-04-19 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 53.680, 102.120, 58.950 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.515 - 2.000 |
R-factor | 0.1992 |
Rwork | 0.197 |
R-free | 0.22380 |
Structure solution method | SAD |
RMSD bond length | 0.002 |
RMSD bond angle | 0.639 |
Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.018 | |
Number of reflections | 22575 | |
<I/σ(I)> | 17.7 | 2 |
Completeness [%] | 99.9 | 100 |
Redundancy | 19.53 | 18.01 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | LIPIDIC CUBIC PHASE | 8 | 293 | 28% PEG550MME, 100 mM Tris-HCl (pH 8.0), 350 mM MgSO4, 3% galactose |