Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL40B2 |
Synchrotron site | SPring-8 |
Beamline | BL40B2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-11-04 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9792, 0.9794, 0.9851 |
Spacegroup name | H 3 2 |
Unit cell lengths | 76.822, 76.822, 85.888 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 38.410 - 2.503 |
R-factor | 0.2264 |
Rwork | 0.223 |
R-free | 0.26550 |
Structure solution method | MAD |
RMSD bond length | 0.007 |
RMSD bond angle | 0.831 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SOLVE |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.410 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Number of reflections | 3504 | 337 |
<I/σ(I)> | 34.4 | 9.03 |
Completeness [%] | 99.9 | 99.4 |
Redundancy | 20.9 | 18.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7 | 293 | Ammonium Sulfate, HEPES, pH 7.0 |