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 | 1998-12-03 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.80 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 165.890, 64.340, 147.140 |
Unit cell angles | 90.00, 98.08, 90.00 |
Refinement procedure
Resolution | 15.000 - 2.400 |
R-factor | 0.246 |
Rwork | 0.246 |
R-free | 0.28300 |
Structure solution method | MULTIPLE ISOMORPHOUS REPLACEMENT USING ANOMALOUS SIGNALS FROM HEAVY ATOMS |
RMSD bond length | 0.007 |
RMSD bond angle | 1.300 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MLPHARE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.460 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.055 | |
Number of reflections | 57973 | |
<I/σ(I)> | 35.06 | 2.9 |
Completeness [%] | 95.9 | 69 |
Redundancy | 9 | 2.25 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICRODIALYSIS | 6.1 | Sodium butylate, pH 6.10, MICRODIALYSIS | |
1 | MICRODIALYSIS | 6.1 | Sodium butylate, pH 6.10, MICRODIALYSIS |