1T2Q
The Crystal Structure of an NNA7 Fab that recognizes an N-type blood group antigen
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RUH2R |
Temperature [K] | 95 |
Detector technology | IMAGE PLATE |
Collection date | 2003-11-11 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 57.863, 77.123, 118.131 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.600 - 1.830 |
R-factor | 0.204 |
Rwork | 0.204 |
R-free | 0.24700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 48G7 |
RMSD bond length | 0.005 |
RMSD bond angle | 1.400 |
Data reduction software | CrystalClear ((MSC/RIGAKU)) |
Data scaling software | CrystalClear ((MSC/RIGAKU)) |
Phasing software | AMoRE ((STAND ALONE)) |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 36.700 | 1.900 |
High resolution limit [Å] | 1.830 | 1.830 |
Number of reflections | 43775 | |
<I/σ(I)> | 12.9 | 2.4 |
Completeness [%] | 92.4 | 53 |
Redundancy | 3.7 | 1.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | PEG MME 5K, ammonium sulfate, MES, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |