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 |