5H9W
Crystal structure of Regnase PIN domain, form II
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2009-04-27 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.0000 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 113.333, 113.333, 78.373 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 26.940 - 2.600 |
R-factor | 0.19347 |
Rwork | 0.191 |
R-free | 0.23142 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5h9v |
RMSD bond length | 0.015 |
RMSD bond angle | 1.718 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 26.940 | 2.690 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.255 | |
Number of reflections | 16940 | |
<I/σ(I)> | 34.3 | 7.9 |
Completeness [%] | 92.9 | 67.8 |
Redundancy | 10.4 | 8.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 1.7 M NaCl, 100 mM HEPES |