6F91
Structure of the family GH92 alpha-mannosidase BT3965 from Bacteroides thetaiotaomicron
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 | 2014-02-23 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 111.919, 184.542, 183.661 |
| Unit cell angles | 90.00, 90.80, 90.00 |
Refinement procedure
| Resolution | 48.080 - 1.800 |
| R-factor | 0.16109 |
| Rwork | 0.160 |
| R-free | 0.18522 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2wvy |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.526 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.080 | 1.830 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.086 | 0.983 |
| Rmeas | 0.114 | 1.296 |
| Rpim | 0.073 | 0.837 |
| Number of reflections | 682384 | 32477 |
| <I/σ(I)> | 10.4 | 1.4 |
| Completeness [%] | 99.5 | 95.8 |
| Redundancy | 4.2 | 4.1 |
| CC(1/2) | 0.997 | 0.672 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 292 | 20% w/v PEG 3350, 0.2 M NaNO3 |
