Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL11-1 |
Synchrotron site | SSRL |
Beamline | BL11-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-05-15 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 110.349, 48.023, 126.317 |
Unit cell angles | 90.00, 111.39, 90.00 |
Refinement procedure
Resolution | 35.090 - 1.900 |
R-factor | 0.163 |
Rwork | 0.161 |
R-free | 0.20000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2faf |
RMSD bond length | 0.010 |
RMSD bond angle | 1.324 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.970 |
High resolution limit [Å] | 1.900 | 4.090 | 1.900 |
Rmerge | 0.117 | 0.061 | 0.596 |
Number of reflections | 95642 | ||
<I/σ(I)> | 7.6 | ||
Completeness [%] | 97.9 | 99.3 | 95.8 |
Redundancy | 4.9 | 5.5 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 293 | 19% PEG6000, 0.1M HEPES pH 7.4, N-OCTANOYL SUCROSE, hanging drop vapor diffusion, temperature 293K, VAPOR DIFFUSION, HANGING DROP |