4BMH
Crystal structure of SsHAT
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-1 |
Synchrotron site | ESRF |
Beamline | ID14-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-10-26 |
Detector | ADSC CCD |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 75.885, 75.885, 76.517 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 65.720 - 1.500 |
R-factor | 0.14769 |
Rwork | 0.146 |
R-free | 0.17457 |
Structure solution method | SIRAS |
Starting model (for MR) | NONE |
RMSD bond length | 0.010 |
RMSD bond angle | 1.255 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | SHELX |
Refinement software | REFMAC (5.6.0086) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 65.720 | 1.580 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.090 | 0.500 |
Number of reflections | 40822 | |
<I/σ(I)> | 20.8 | 4.9 |
Completeness [%] | 99.2 | 98.3 |
Redundancy | 12.3 | 11.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 0.2 M MGCL2, 0.1 M IMIDAZOLE PH8.0 AND 25% PEG3350 |