9Y12
Crystal Structure of N-Acetyl Transferase Domain-Containing Protein from Bacteroides fragilis
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 | 2009-12-20 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97901 |
| Spacegroup name | P 31 |
| Unit cell lengths | 92.963, 92.963, 218.508 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.480 - 2.500 |
| R-factor | 0.1992 |
| Rwork | 0.189 |
| R-free | 0.22350 |
| Structure solution method | SAD |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.466 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX (1.21.2_5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.540 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.202 | 1.005 |
| Rmeas | 0.225 | 1.124 |
| Rpim | 0.098 | 0.499 |
| Number of reflections | 72028 | 3574 |
| <I/σ(I)> | 11.8 | 1.6 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 5.2 | |
| CC(1/2) | 0.973 | 0.457 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 10.5 | 295 | 0.2 M lithium sulfate, 0.1 M CAPS pH 10.5, 2.0 M ammonium sulfate |
