4W8B
Crystal structure of XEG5B, a GH5 xyloglucan-specific beta-1,4-glucanase from ruminal metagenomic library, in complex with XXLG
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | LNLS BEAMLINE W01B-MX2 |
| Synchrotron site | LNLS |
| Beamline | W01B-MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-01-01 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.954 |
| Spacegroup name | P 61 |
| Unit cell lengths | 120.632, 120.632, 59.004 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 39.490 - 1.150 |
| R-factor | 0.1041 |
| Rwork | 0.103 |
| R-free | 0.12240 |
| RMSD bond length | 0.025 |
| RMSD bond angle | 2.192 |
| Data scaling software | XDS |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.220 | |
| High resolution limit [Å] | 1.150 | 3.440 | 1.150 |
| Rmerge | 0.053 | 0.020 | |
| Rmeas | 0.056 | 0.022 | 0.294 |
| Total number of observations | 1377786 | ||
| Number of reflections | 165780 | 6643 | 23972 |
| <I/σ(I)> | 26.38 | 81.55 | |
| Completeness [%] | 95.7 | 99.9 | 85.9 |
| Redundancy | 8.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 291 | ammonium sulfate, sodium citrate, glycerol |
