3ZMR
Bacteroides ovatus GH5 xyloglucanase in complex with a XXXG heptasaccharide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-04-21 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 46.830, 147.240, 84.140 |
| Unit cell angles | 90.00, 92.84, 90.00 |
Refinement procedure
| Resolution | 72.990 - 1.430 |
| R-factor | 0.1241 |
| Rwork | 0.122 |
| R-free | 0.15722 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2jep |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.462 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 72.990 | 1.470 |
| High resolution limit [Å] | 1.430 | 1.430 |
| Rmerge | 0.060 | 0.580 |
| Number of reflections | 207943 | |
| <I/σ(I)> | 12.2 | 2.2 |
| Completeness [%] | 99.5 | 99.8 |
| Redundancy | 4.1 | 4.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 0.1 M BIS-TRIS PH 6.5, 20% W/V POLYETHYLENE GLYCOL MONOMETHYL ETHER 5,000 |
