2JAL
Beta-glucosidase from Thermotoga maritima in complex with cyclophellitol
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-09-30 |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 94.699, 94.466, 113.591 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 72.740 - 1.900 |
R-factor | 0.198 |
Rwork | 0.196 |
R-free | 0.24400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1od0 |
RMSD bond length | 0.015 |
RMSD bond angle | 1.439 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.3.0011) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.970 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.040 | 0.280 |
Number of reflections | 76161 | |
<I/σ(I)> | 19.2 | 3.5 |
Completeness [%] | 94.6 | 78.3 |
Redundancy | 3.3 | 2.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7 | 10 MG/ML PROTEIN. 15% PEG 4K, 0.1 M IMIDAZOLE, 0.2 M CALCIUM ACETATE., pH 7.00 |