2VZN
Crystal structure of the major allergen from fire ant venom, Sol i 3
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-02-02 |
| Detector | MARRESEARCH |
| Spacegroup name | P 61 |
| Unit cell lengths | 93.355, 93.355, 144.051 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 30.000 - 3.050 |
| R-factor | 0.203 |
| Rwork | 0.201 |
| R-free | 0.23900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1qnx |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.016 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (TRUNCATE) |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 80.850 | 3.070 |
| High resolution limit [Å] | 3.040 | 3.040 |
| Rmerge | 0.100 | 0.400 |
| Number of reflections | 13121 | |
| <I/σ(I)> | 9.07 | 1.37 |
| Completeness [%] | 96.6 | 96.6 |
| Redundancy | 2.68 | 2.52 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | THE HANGING-DROP VAPOR WATER (9.9 MG/ML) WAS MIXED WITH RESERVOIR SOLUTION (19% (W/V) POLYETHYLENE GLYCOL (PEG) 1000, 100 MM TRIS-HCL, PH 8.5) AT A RATIO OF 1:1. |
