5CAD
Crystal structure of the vicilin from Solanum melongena revealed existence of different anionic ligands in structurally similar pockets
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-11-20 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.95372 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 119.330, 119.330, 158.190 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 22.710 - 1.490 |
| Rwork | 0.199 |
| R-free | 0.21020 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.969 |
| Phasing software | PHENIX (1.8.1) |
| Refinement software | CNS (1.3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 22.710 | 1.570 |
| High resolution limit [Å] | 1.490 | 1.490 |
| Rmerge | 0.061 | 0.476 |
| Number of reflections | 70495 | |
| <I/σ(I)> | 20.5 | 4.3 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 11.8 | 10.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 50mM Tris-Cl, 1.5 M Sodium malonate, 10% Peg 3350 |
