4GAI
Crystal structure of EBI-005, a chimera of human IL-1beta and IL-1Ra
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-08-28 |
Detector | RAYONIX MX-300 |
Wavelength(s) | 0.9795 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 43.392, 66.910, 216.266 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.490 |
R-factor | 0.1888 |
Rwork | 0.187 |
R-free | 0.21940 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.020 |
RMSD bond angle | 1.342 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.540 |
High resolution limit [Å] | 1.490 | 3.210 | 1.490 |
Rmerge | 0.060 | 0.041 | 0.582 |
Number of reflections | 51907 | ||
<I/σ(I)> | 12 | ||
Completeness [%] | 99.8 | 98.4 | 99.4 |
Redundancy | 5.7 | 5.8 | 5.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 25% PEG 3350, 200 mM MgCl2, 100 mM HEPES, pH 7.5, 0.5% w/v n-Dodecy- -D-maltoside (DDM), VAPOR DIFFUSION, HANGING DROP, temperature 298K |