3RFN
Epitope backbone grafting by computational design for improved presentation of linear epitopes on scaffold proteins
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 93.2 |
Detector technology | IMAGE PLATE |
Collection date | 2010-12-03 |
Detector | MAR scanner 345 mm plate |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 93.800, 36.100, 46.300 |
Unit cell angles | 90.00, 99.40, 90.00 |
Refinement procedure
Resolution | 17.000 - 1.800 |
R-factor | 0.219 |
Rwork | 0.219 |
R-free | 0.23700 |
Structure solution method | MIR |
Starting model (for MR) | 1wnu |
RMSD bond length | 0.007 |
RMSD bond angle | 1.600 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | CNS (1.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 17.000 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 15316 | |
<I/σ(I)> | 25 | 5.9 |
Completeness [%] | 97.7 | 89 |
Redundancy | 1.75 | 1.44 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 2.8 M NaCl, 0.1 M Tris, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K |