4IHR
Crystal structure of recombinant kirola (Act d 11)
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 | 2011-07-06 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9772 |
| Spacegroup name | P 63 2 2 |
| Unit cell lengths | 72.060, 72.060, 113.585 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 34.370 - 1.600 |
| R-factor | 0.17703 |
| Rwork | 0.175 |
| R-free | 0.21230 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 4igv |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.824 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.630 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.060 | 0.834 |
| Number of reflections | 23683 | |
| <I/σ(I)> | 55.2 | 3.4 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 20.9 | 17.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293 | 0.15 M citric acid, 0.35 M magnesium chloride, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
