2ISH
Botulinum Neurotoxin A Light Chain WT Crystal Form C
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 | 2006-02-24 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.20 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 39.022, 197.377, 58.314 |
| Unit cell angles | 90.00, 90.02, 90.00 |
Refinement procedure
| Resolution | 37.670 - 2.000 |
| R-factor | 0.233 |
| Rwork | 0.233 |
| R-free | 0.26700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1xtf |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.100 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 37.670 |
| High resolution limit [Å] | 2.000 |
| Number of reflections | 57727 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 18% PEG MME 5000, 100 mM Bis-Tris pH 6.5, 0.5 mM ZnCl2, 0.3 M NDSB-195, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
