3OFW
Crystal structure of recombinant Kunitz Type serine protease Inhibitor-1 from the Carribean sea anemone stichodactyla helianthus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 288 |
Detector technology | IMAGE PLATE |
Collection date | 2010-05-10 |
Detector | MARRESEARCH |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 37.158, 37.158, 114.980 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.350 - 2.500 |
R-factor | 0.19118 |
Rwork | 0.190 |
R-free | 0.22103 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1shp |
RMSD bond length | 0.012 |
RMSD bond angle | 1.402 |
Data reduction software | DENZO |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.358 | 2.640 |
High resolution limit [Å] | 2.500 | 2.500 |
Number of reflections | 3127 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 288.15 | 1.7 M ammonium sulphate, 0.1 M Tris-HCl, 6% glycerol, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 288.15K |