3GM0
Anti-methamphetamine single chain Fv in complex with MDMA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-1 |
Synchrotron site | SSRL |
Beamline | BL9-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-06-18 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97945 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 34.720, 64.806, 48.322 |
Unit cell angles | 90.00, 98.97, 90.00 |
Refinement procedure
Resolution | 15.000 - 2.400 |
Rwork | 0.214 |
R-free | 0.27100 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.337 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.400 | 2.580 |
High resolution limit [Å] | 2.400 | 2.400 |
Number of reflections | 8316 | |
Completeness [%] | 99.8 | 99.5 |
Redundancy | 3.75 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 8.3 | 287 | 1.15M sodium Citrate, 0.28M Imidazole malate, pH 8.3, VAPOR DIFFUSION, temperature 287K |