2A6K
Crystal Structure Analysis of the germline antibody 36-65 Fab in complex with the dodecapeptide SLGDNLTNHNLR
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 120 |
Detector technology | IMAGE PLATE |
Collection date | 2003-08-10 |
Detector | MARRESEARCH |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 53.135, 144.920, 70.991 |
Unit cell angles | 90.00, 104.35, 90.00 |
Refinement procedure
Resolution | 50.000 - 3.000 |
R-factor | 0.246 |
Rwork | 0.245 |
R-free | 0.26400 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.735 |
Data reduction software | AUTOMAR |
Phasing software | AMoRE |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.110 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.123 | |
Number of reflections | 19662 | |
<I/σ(I)> | 4 | |
Completeness [%] | 94.9 | 95.9 |
Redundancy | 3.04 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.7 | 298 | 20% PEG 8000, cacodylate, azide, pH 6.7, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K |