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 | 2002-07-04 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.984 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 135.822, 145.712, 148.554 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.300 - 3.000 |
R-factor | 0.2453 |
Rwork | 0.243 |
R-free | 0.28290 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1OP3 |
RMSD bond length | 0.004 |
RMSD bond angle | 0.931 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | PHENIX ((1.12_2829)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.300 | 3.050 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.072 | 0.484 |
Number of reflections | 29134 | 1346 |
<I/σ(I)> | 27.2 | 3.1 |
Completeness [%] | 97.5 | 89.9 |
Redundancy | 4.5 | 4.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 295 | 25% Peg 400, 0.2M imidazole malate |