2A1W
Anti-cocaine antibody 7.5.21, crystal form I
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU300 |
Temperature [K] | 277 |
Detector technology | IMAGE PLATE |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 178.601, 58.395, 98.098 |
Unit cell angles | 90.00, 110.66, 90.00 |
Refinement procedure
Resolution | 30.500 - 2.700 |
R-factor | 0.188 |
Rwork | 0.185 |
R-free | 0.24700 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.184 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.500 | 2.800 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.174 | |
Number of reflections | 26324 | |
<I/σ(I)> | 10.6 | 2 |
Completeness [%] | 99.9 | 99.96 |
Redundancy | 4.9 | 4.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298 | 16% PEG8000, 0.3M ammonium sulfate, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K |