6HQ8
Bacterial beta-1,3-oligosaccharide phosphorylase from GH149 with laminarihexaose bound at a surface site
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-06-24 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 99.129, 158.756, 178.891 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 66.410 - 2.250 |
| R-factor | 0.1817 |
| Rwork | 0.180 |
| R-free | 0.21730 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 6hq6 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.210 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.1) |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 66.410 | 66.410 | 2.290 |
| High resolution limit [Å] | 2.250 | 12.320 | 2.250 |
| Rmerge | 0.132 | 0.028 | 2.024 |
| Rmeas | 0.138 | 0.029 | 2.103 |
| Rpim | 0.037 | 0.009 | 0.569 |
| Total number of observations | 1808389 | ||
| Number of reflections | 134201 | 938 | 6512 |
| <I/σ(I)> | 13.5 | ||
| Completeness [%] | 100.0 | 98.9 | 100 |
| Redundancy | 13.5 | 11.5 | 13.6 |
| CC(1/2) | 0.999 | 0.999 | 0.637 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 9 | 293 | Null |
