3DL7
Aged Form of Mouse Acetylcholinesterase Inhibited by Tabun- Update
Experimental procedure
| Experimental method | SINGLE WAVELENGTH | 
| Source type | SYNCHROTRON | 
| Source details | MAX II BEAMLINE I711 | 
| Synchrotron site | MAX II | 
| Beamline | I711 | 
| Temperature [K] | 100 | 
| Detector technology | CCD | 
| Collection date | 2005-03-08 | 
| Detector | MAR CCD | 
| Wavelength(s) | 0.9694 | 
| Spacegroup name | P 21 21 21 | 
| Unit cell lengths | 79.020, 110.880, 226.380 | 
| Unit cell angles | 90.00, 90.00, 90.00 | 
Refinement procedure
| Resolution | 28.820 - 2.500 | 
| R-factor | 0.188 | 
| Rwork | 0.187 | 
| R-free | 0.22700 | 
| Structure solution method | MOLECULAR REPLACEMENT | 
| RMSD bond length | 0.013 | 
| RMSD bond angle | 1.461 | 
| Data reduction software | XDS | 
| Data scaling software | XDS | 
| Phasing software | MOLREP | 
| Refinement software | REFMAC (5.2.0019) | 
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.000 | 2.640 | 
| High resolution limit [Å] | 2.500 | 2.500 | 
| Rmerge | 0.070 | 0.510 | 
| Number of reflections | 69074 | |
| <I/σ(I)> | 17.6 | 7.5 | 
| Completeness [%] | 99.3 | 99 | 
| Redundancy | 7.4 | 7.5 | 
Crystallization Conditions
| crystal ID | method | pH | temperature | details | 
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 277 | 27-31 % (V/V) PEG750MME, 0.1M HEPES, 100 mM HEPES, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K | 











