6B4Z
Schistosoma mansoni (Blood Fluke) Sulfotransferase, T157S Mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2014-05-16 |
Detector | RIGAKU RAXIS HTC |
Wavelength(s) | 1.54178 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 140.005, 39.316, 54.079 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.796 - 1.740 |
R-factor | 0.1757 |
Rwork | 0.173 |
R-free | 0.20770 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5byk |
RMSD bond length | 0.006 |
RMSD bond angle | 1.115 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.670 | 1.830 |
High resolution limit [Å] | 1.740 | 1.740 |
Rpim | 0.050 | 0.426 |
Number of reflections | 31578 | 4517 |
<I/σ(I)> | 14 | 2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 6.8 | 6.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 1.0 M sodium citrate, 0.1 M sodium cacodylate, pH 6.5 |