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 | 2005-03-12 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97945 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 45.210, 165.712, 169.574 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 41.071 - 2.758 |
R-factor | 0.22 |
Rwork | 0.218 |
R-free | 0.25160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1OP3 |
RMSD bond length | 0.005 |
RMSD bond angle | 0.969 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX ((1.12_2829)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.800 |
High resolution limit [Å] | 2.750 | 2.750 |
Rmerge | 0.102 | 0.657 |
Number of reflections | 33657 | 1675 |
<I/σ(I)> | 13 | 1.79 |
Completeness [%] | 99.5 | 99.6 |
Redundancy | 3.5 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 295 | 20% PEG 4000, 0.2M imidazole malate |