5F5X
Crystal structure of S116A Ba3275 with AMP bound
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 | 2015-05-27 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 55.116, 117.728, 54.852 |
| Unit cell angles | 90.00, 95.27, 90.00 |
Refinement procedure
| Resolution | 31.922 - 2.006 |
| R-factor | 0.2149 |
| Rwork | 0.213 |
| R-free | 0.24660 |
| Structure solution method | SAD |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.731 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | MOLREP |
| Refinement software | PHENIX (dev_1888) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 32.000 |
| High resolution limit [Å] | 2.000 |
| Rmerge | 0.087 |
| Number of reflections | 45151 |
| <I/σ(I)> | 11.6 |
| Completeness [%] | 97.6 |
| Redundancy | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5 | 293 | Malate pH 5.0 0.15M, Peg 1000 %(w/v), Sodium fluoride 0.004 M |
