4Q93
Crystal structure of resveratrol bound human tyrosyl tRNA synthetase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2012-06-01 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5000 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 73.966, 162.550, 35.014 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.010 - 2.100 |
R-factor | 0.17723 |
Rwork | 0.174 |
R-free | 0.23071 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1n3l |
RMSD bond length | 0.018 |
RMSD bond angle | 2.071 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.140 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.055 | 0.271 |
Number of reflections | 25438 | |
<I/σ(I)> | 28.5 | 4.1 |
Completeness [%] | 99.0 | 93.2 |
Redundancy | 4.5 | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 295 | 2.1 M ammonium sulfate, 0.1 M sodium phosphate monobasic / potassium phosphate dibasic, pH 6-8, 2% acetone, VAPOR DIFFUSION, HANGING DROP, temperature 295K |