5NBO
Bacteroides ovatus mixed linkage glucan PUL (MLGUL) GH16
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 | 2015-12-03 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.976 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 167.466, 60.801, 49.385 |
| Unit cell angles | 90.00, 94.49, 90.00 |
Refinement procedure
| Resolution | 49.230 - 1.800 |
| R-factor | 0.16351 |
| Rwork | 0.161 |
| R-free | 0.20414 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4crq |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.830 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.230 | 1.840 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.067 | 0.446 |
| Rpim | 0.053 | 0.365 |
| Number of reflections | 45483 | 2726 |
| <I/σ(I)> | 10 | 2 |
| Completeness [%] | 98.9 | 99.9 |
| Redundancy | 3 | 3 |
| CC(1/2) | 0.996 | 0.669 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 100 mM MES pH 6 200 mM LiCl2 15-25% Peg-6000 |
