4Y40
Structure of Vaspin mutant D305C V383C
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-05-31 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.91841 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 133.495, 152.340, 61.611 |
| Unit cell angles | 90.00, 97.05, 90.00 |
Refinement procedure
| Resolution | 19.690 - 2.200 |
| R-factor | 0.1807 |
| Rwork | 0.180 |
| R-free | 0.20580 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4if8 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.080 |
| Data reduction software | XDS (November 11, 2013) |
| Data scaling software | XSCALE (November 11, 2013) |
| Phasing software | REFMAC (5.7.0029) |
| Refinement software | BUSTER (2.10.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.690 | 2.260 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.145 | 1.554 |
| Number of reflections | 61535 | |
| <I/σ(I)> | 7.9 | 0.9 |
| Completeness [%] | 99.6 | 96.3 |
| Redundancy | 5.6 | 4.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4 | 291 | 6 % (w/v) polyethylene glycol 6000, 0.1 M citirc acid pH 3.5 -4.5 |
