4B9Y
Crystal Structure of Apo Agd31B, alpha-transglucosylase in Glycoside Hydrolase Family 31
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC CCD |
| Spacegroup name | P 6 2 2 |
| Unit cell lengths | 197.329, 197.329, 103.032 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 49.324 - 1.900 |
| R-factor | 0.1641 |
| Rwork | 0.163 |
| R-free | 0.19100 |
| Structure solution method | SAD |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.064 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALEPACK |
| Phasing software | autoSHARP |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.300 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.100 | 0.520 |
| Number of reflections | 92667 | |
| <I/σ(I)> | 21.5 | 6 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 22 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 1.8 M AMMONIUM SULFATE, 0.1 M HEPES (PH7.0), 2% PEG400 |
