3JXS
Crystal structure of XG34, an evolved xyloglucan binding CBM
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | MAX II BEAMLINE I911-2 |
| Synchrotron site | MAX II |
| Beamline | I911-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-02-28 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.03805 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 59.570, 43.760, 93.080 |
| Unit cell angles | 90.00, 104.27, 90.00 |
Refinement procedure
| Resolution | 40.000 - 1.600 |
| R-factor | 0.17041 |
| Rwork | 0.169 |
| R-free | 0.21335 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1k45 |
| RMSD bond length | 0.022 |
| RMSD bond angle | 1.921 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0066) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 90.200 | 1.700 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Number of reflections | 61533 | |
| <I/σ(I)> | 18.9 | 2.8 |
| Completeness [%] | 99.6 | 99.6 |
| Redundancy | 4.2 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 0.1 M sodium acetate, 30 % MPD, 0.02 M CaCl2, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
