3F6A
Crystal structure of a hydrolase, NUDIX family from Clostridium perfringens
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X12C |
| Synchrotron site | NSLS |
| Beamline | X12C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-10-29 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 41.076, 62.614, 120.273 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 34.350 - 2.020 |
| R-factor | 0.226 |
| Rwork | 0.226 |
| R-free | 0.26300 |
| Structure solution method | SAD |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.400 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SHELXD |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.350 | 2.090 |
| High resolution limit [Å] | 2.020 | 2.020 |
| Rmerge | 0.098 | 0.334 |
| Number of reflections | 21021 | |
| <I/σ(I)> | 11.8 | 1 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 12.9 | 11.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 3.5 | 298 | 0.1M citric acid, 3.0M sodium chloride, pH 3.5, VAPOR DIFFUSION, SITTING DROP, temperature 298.0K |
