1AMN
TRANSITION STATE ANALOG: ACETYLCHOLINESTERASE COMPLEXED WITH M-(N,N,N-TRIMETHYLAMMONIO)TRIFLUOROACETOPHENONE
Experimental procedure
Detector technology | AREA DETECTOR |
Collection date | 1993-05-15 |
Detector | XENTRONICS |
Wavelength(s) | 1.5418 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 113.540, 113.540, 137.530 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 8.000 - 2.800 |
R-factor | 0.188 |
Rwork | 0.188 |
R-free | 0.23500 |
RMSD bond length | 0.011 |
RMSD bond angle | 24.110 * |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | X-PLOR |
Refinement software | X-PLOR |
Data quality characteristics
Overall | |
High resolution limit [Å] | 2.800 * |
Rmerge | 0.118 |
Number of reflections | 25272 |
Completeness [%] | 98.0 |
Redundancy | 3.08 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |