1WZ9
The 2.1 A structure of a tumour suppressing serpin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2004-10-02 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 54.115, 95.047, 139.225 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 78.570 - 2.100 |
R-factor | 0.20729 |
Rwork | 0.205 |
R-free | 0.24933 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1xu8 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.152 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 78.600 |
High resolution limit [Å] | 2.100 |
Rmerge | 0.045 |
Number of reflections | 42714 |
<I/σ(I)> | 22.2 |
Completeness [%] | 99.8 |
Redundancy | 36.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.3 | 295 | 0.1M BisTris, 2.9M (NH4)2SO4, pH 8.3, VAPOR DIFFUSION, HANGING DROP, temperature 295K |