2X41
Structure of beta-glucosidase 3B from Thermotoga neapolitana in complex with glucose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I911-3 |
Synchrotron site | MAX II |
Beamline | I911-3 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-09-24 |
Detector | MARRESEARCH |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 75.130, 128.460, 176.290 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 26.719 - 2.050 |
R-factor | 0.1889 |
Rwork | 0.187 |
R-free | 0.22510 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2x40 |
RMSD bond length | 0.004 |
RMSD bond angle | 0.776 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | REFMAC |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 26.700 | 2.100 |
High resolution limit [Å] | 2.050 | 2.050 |
Rmerge | 0.060 | 0.670 |
Number of reflections | 53087 | |
<I/σ(I)> | 14.1 | 2 |
Completeness [%] | 98.6 | 99.6 |
Redundancy | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.4 | 293 | 3-5 MG/ML PROTEIN, 16-18 % PEG 3350, 0.2 M NABR, 90 MM BIS-TRIS PROPANE PH 7.4, 20C |