1YVK
Crystal Structure of the Bacillis subtilis Acetyltransferase in complex with CoA, Northeast Structural Genomics Target SR237.
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4A |
| Synchrotron site | NSLS |
| Beamline | X4A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-02-07 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.97927 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 59.596, 124.425, 216.942 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.000 - 3.010 |
| R-factor | 0.243 |
| Rwork | 0.243 |
| R-free | 0.28400 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.000 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SnB |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 3.110 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.108 | 0.448 |
| Number of reflections | 29334 | |
| <I/σ(I)> | 14.01 | 2.32 |
| Completeness [%] | 95.7 | 77.6 |
| Redundancy | 5.8 | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 100 mM Tris-HCl (pH 8.5), 20% PEG 4K, 200 mM sodium acetate, 100 mM ammonium sulfate, 2 mM Acetyl-CoA, and 5 mM DTT., VAPOR DIFFUSION, HANGING DROP, temperature 293K |
