4OIY
Crystal structure of Sec7p catalytic domain
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-11-16 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97913 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.647, 68.961, 59.605 |
| Unit cell angles | 90.00, 106.74, 90.00 |
Refinement procedure
| Resolution | 36.270 - 1.500 |
| R-factor | 0.21243 |
| Rwork | 0.211 |
| R-free | 0.23683 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1r8m |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.016 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.530 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.062 | 0.540 |
| Number of reflections | 58905 | |
| <I/σ(I)> | 18.8 | 2.4 |
| Completeness [%] | 97.4 | 95.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 289 | 20% PEGMME550, 50mM MgCl2, 100mM Tris-Cl, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K |
