3F0A
Structure of a putative n-acetyltransferase (ta0374) in complex with acetyl-coa from thermoplasma acidophilum
Experimental procedure
| Experimental method | SAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-D |
| Synchrotron site | APS |
| Beamline | 21-ID-D |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-10-10 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 69.038, 69.038, 89.193 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 54.550 - 2.500 |
| R-factor | 0.18 |
| Rwork | 0.177 |
| R-free | 0.22900 |
| Structure solution method | SAD |
| Starting model (for MR) | 1tiq |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.582 |
| Data reduction software | CrystalClear |
| Data scaling software | HKL-2000 |
| Phasing software | BALBES |
| Refinement software | REFMAC (5.5.0051) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 54.550 | 1.930 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.490 | |
| Number of reflections | 7926 | |
| <I/σ(I)> | 3.794 | 0.2 |
| Completeness [%] | 20.8 | 99.7 |
| Redundancy | 1.2 | 1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 295 | 0.1M Na Acetate, 30% PEG6000, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
