3S34
Structure of the 1121B Fab fragment
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-01-22 |
Detector | RIGAKU SATURN 944 |
Wavelength(s) | 1.54 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 66.426, 66.426, 203.868 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 50.100 - 2.200 |
R-factor | 0.1852 |
Rwork | 0.183 |
R-free | 0.22311 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1yy9 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.372 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 70.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.219 | |
Number of reflections | 26790 | |
<I/σ(I)> | 20.5 | 4.5 |
Completeness [%] | 97.5 | 78.7 |
Redundancy | 7 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 298 | 100 mM Na/K phosphate, pH 5.5, 40% PEG 400, VAPOR DIFFUSION, HANGING DROP, temperature 298K |