3NZ2
Crystal Structure of Hexapeptide-Repeat containing-Acetyltransferase VCA0836 Complexed with Acetyl Co Enzyme A from Vibrio cholerae O1 biovar eltor
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 | 2009-11-30 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9793 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 77.316, 135.801, 120.535 |
| Unit cell angles | 90.00, 91.77, 90.00 |
Refinement procedure
| Resolution | 46.632 - 2.350 |
| R-factor | 0.1912 |
| Rwork | 0.188 |
| R-free | 0.25340 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDBID 3ECT |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.443 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX ((phenix.refine: 1.6.2_432)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.390 |
| High resolution limit [Å] | 2.350 | 2.350 |
| Number of reflections | 100668 | |
| <I/σ(I)> | 4.6 | 2.2 |
| Completeness [%] | 97.7 | 99.2 |
| Redundancy | 29.8 | 4.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 298 | 0.1 M Acetate pH 4.5, 20% (v/v) 1,4-butanediol, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
