1NJ9
Cocaine hydrolytic antibody 15A10
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-2 |
| Synchrotron site | SSRL |
| Beamline | BL9-2 |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 2002-02-20 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 1.07 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 37.500, 108.400, 111.300 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.000 - 2.350 |
| R-factor | 0.201 |
| Rwork | 0.199 |
| R-free | 0.28300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 * |
| RMSD bond angle | 1.500 * |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | EPMR |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.450 |
| High resolution limit [Å] | 2.350 | 2.350 |
| Rmerge | 0.083 | 0.399 |
| Total number of observations | 91574 * | |
| Number of reflections | 32009 | |
| <I/σ(I)> | 14.4 | 2.8 |
| Completeness [%] | 85.4 | 76.6 |
| Redundancy | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 * | 296 | Larsen, N.A., (2002) Acta Crystallogr.,Sect.D, 58, 2055. * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 20 (mg/ml) | |
| 2 | 1 | drop | sodium acetate | 0.2 (M) | pH5.5 |
| 3 | 1 | reservoir | PEG4000 | 12 (%) | |
| 4 | 1 | reservoir | 2-propanol | 12-14 (%) | |
| 5 | 1 | reservoir | MES | 100 (mM) | pH5.4 |
