3SRT
The crystal structure of a maltose O-acetyltransferase from Clostridium difficile 630
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-06-11 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97931 |
| Spacegroup name | P 21 3 |
| Unit cell lengths | 152.884, 152.884, 152.884 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.346 - 2.504 |
| R-factor | 0.1647 |
| Rwork | 0.164 |
| R-free | 0.18590 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.131 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | SHELXD |
| Refinement software | PHENIX ((phenix.refine: 1.7_650)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.500 | 2.540 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.098 | 0.757 |
| Number of reflections | 41225 | |
| <I/σ(I)> | 29 | 2.6 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 7.1 | 6.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 286 | 1.8M Ammonium Citrate Tribasic, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 286K |
