5NBP
Bacteroides ovatus mixed linkage glucan PUL (MLGUL) GH16 in complex with G4G4G3G Product
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-02-01 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.979 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 167.342, 60.149, 49.673 |
| Unit cell angles | 90.00, 93.75, 90.00 |
Refinement procedure
| Resolution | 49.570 - 1.800 |
| R-factor | 0.1769 |
| Rwork | 0.175 |
| R-free | 0.21290 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 5nbo |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.636 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.570 | 1.840 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.735 | |
| Rpim | 0.066 | 0.499 |
| Number of reflections | 45347 | 2705 |
| <I/σ(I)> | 10.8 | 1.7 |
| Completeness [%] | 99.0 | 99 |
| Redundancy | 3.9 | 3.9 |
| CC(1/2) | 0.994 | 0.516 |
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 % w/v PEG-6000 |
