3DSB
The crystal structure of a possible 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 | 2008-03-20 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97932 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 41.488, 66.765, 133.884 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.100 - 1.480 |
| R-factor | 0.17017 |
| Rwork | 0.168 |
| R-free | 0.20526 |
| Structure solution method | SAD |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.545 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | SHELXD |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.100 | 1.510 |
| High resolution limit [Å] | 1.480 | 1.480 |
| Rmerge | 0.099 | 0.462 |
| Number of reflections | 62315 | |
| <I/σ(I)> | 42.4 | 4 |
| Completeness [%] | 98.4 | 90.7 |
| Redundancy | 7.4 | 6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4 | 277 | 0.1M Ammonium Sulfate 0.1M Tris-Sodium Citrate, pH 4, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
