3L2M
X-ray Crystallographic Analysis of Pig Pancreatic Alpha-Amylase with Alpha-cyclodextrin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 298 |
Detector technology | AREA DETECTOR |
Collection date | 1993-06-17 |
Detector | SDMS |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 70.650, 114.880, 118.850 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.300 - 1.970 |
R-factor | 0.13005 |
Rwork | 0.127 |
R-free | 0.16021 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.387 |
Data reduction software | SDMS (Detector System) |
Data scaling software | SDMS (Detector System) |
Refinement software | REFMAC (5.5.0089) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.300 | 2.070 |
High resolution limit [Å] | 1.970 | 1.970 |
Rmerge | 0.068 | 0.178 |
Number of reflections | 62592 | |
<I/σ(I)> | 19.83 | 3.07 |
Completeness [%] | 84.6 | 36.6 |
Redundancy | 4.84 | 1.61 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 6.75 | 298 | 0.010 M cacodylate, 0.002 M calcium chloride, soaking of alpha-cyclodextrin, pH 6.75, EVAPORATION, temperature 298K |