Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL13B1 |
Synchrotron site | NSRRC |
Beamline | BL13B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-03-21 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97898 |
Spacegroup name | P 31 |
Unit cell lengths | 78.493, 78.493, 50.409 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 25.693 - 2.200 |
R-factor | 0.2004 |
Rwork | 0.194 |
R-free | 0.25090 |
Structure solution method | SAD |
RMSD bond length | 0.008 |
RMSD bond angle | 1.142 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | |
High resolution limit [Å] | 2.200 | 2.200 |
Number of reflections | 17389 | |
Completeness [%] | 90.0 | 100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 298 | Tris 8.0, 20% PEG 3350 MME, VAPOR DIFFUSION, SITTING DROP, temperature 100K, temperature 298K |