3S9A
Russell's viper venom serine proteinase, RVV-V (closed-form)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-04-21 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 1.0 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 78.928, 78.928, 157.370 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 35.280 - 1.900 |
R-factor | 0.22 |
Rwork | 0.219 |
R-free | 0.25550 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2aiq |
RMSD bond length | 0.005 |
RMSD bond angle | 1.300 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | CNS (1.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.970 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.063 | 0.255 |
Number of reflections | 23547 | |
<I/σ(I)> | 22.8 | 8.6 |
Completeness [%] | 99.8 | 100 |
Redundancy | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5 | 293 | 16% PEG 3350, 50mM sodium citrate, 50mM bis-tris propane , pH 5.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K |