3FO9
Crystal structure of aldolase antibody 33F12 Fab' in complex with hapten 1,3-diketone
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.1 |
Synchrotron site | ALS |
Beamline | 8.2.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-07-06 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 65.830, 81.038, 174.314 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.560 - 1.900 |
R-factor | 0.216 |
Rwork | 0.215 |
R-free | 0.24900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1axt |
RMSD bond length | 0.011 |
RMSD bond angle | 1.308 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 43.560 | 50.000 | 1.940 |
High resolution limit [Å] | 1.900 | 4.680 | 1.900 |
Rmerge | 0.054 | 0.040 | 0.486 |
Number of reflections | 71502 | ||
<I/σ(I)> | 36.891 | ||
Completeness [%] | 96.1 | 97.5 | 71.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 7.4 | 295 | 30% PEG 4000, 10% isopropanol, 0.1M Hepes., pH 7.4, EVAPORATION, temperature 295K |