1ESW
X-RAY STRUCTURE OF ACARBOSE BOUND TO AMYLOMALTASE FROM THERMUS AQUATICUS. IMPLICATIONS FOR THE SYNTHESIS OF LARGE CYCLIC GLUCANS
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X11 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X11 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 1999-03-25 |
Detector | MARRESEARCH |
Spacegroup name | P 64 |
Unit cell lengths | 154.000, 154.000, 64.200 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 500.000 - 1.900 |
Rwork | 0.192 |
R-free | 0.21900 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.600 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 * | 1.960 |
High resolution limit [Å] | 1.890 | 1.890 |
Rmerge | 0.041 | 0.262 |
Number of reflections | 66004 * | |
<I/σ(I)> | 15.2 | |
Completeness [%] | 94.4 | 74.2 |
Redundancy | 4.58 | 4.03 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.6 * | 291 | Bicine, PEG 8000, Ethylene glycol, NaCl , pH 9.0, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 10 (mg/ml) | |
2 | 1 | drop | Tris-HCl | 5 (mM) | |
3 | 1 | drop | dithiothreitol | 1 (mM) | |
4 | 1 | drop | 100 (mM) | ||
5 | 1 | reservoir | PEG8000 | 17 (%(w/v)) | |
6 | 1 | reservoir | HEPES | 100 (mM) | |
7 | 1 | reservoir | 100 (mM) |