3U00
Crystal structure of wild-type onconase at 1.65 A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SEALED TUBE |
Source details | OXFORD DIFFRACTION ENHANCE ULTRA |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2011-09-22 |
Detector | AGILENT ATLAS CCD |
Wavelength(s) | 1.54 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 32.509, 39.454, 69.985 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 15.029 - 1.650 |
R-factor | 0.17661 |
Rwork | 0.171 |
R-free | 0.22510 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1onc |
RMSD bond length | 0.021 |
RMSD bond angle | 1.979 |
Data reduction software | CrysalisPro |
Data scaling software | SCALA (3.3.16) |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 15.029 |
High resolution limit [Å] | 1.650 |
Number of reflections | 11256 |
<I/σ(I)> | 5.8 |
Completeness [%] | 93.8 |
Redundancy | 2.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 298 | 20% w/v PEG8000, 0.05 M potassium phosphate monobasic, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |