5CBA
3B4 in complex with CXCL13 - 3B4-CXCL13
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 193 |
Detector technology | PIXEL |
Collection date | 2013-10-09 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 1.0 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 119.350, 55.680, 112.770 |
Unit cell angles | 90.00, 120.56, 90.00 |
Refinement procedure
Resolution | 48.700 - 2.500 |
R-factor | 0.1994 |
Rwork | 0.197 |
R-free | 0.23710 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3B4 and 3GV3/2R3Z/4HSV/3IL8 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.050 |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.5) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.700 | 2.511 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.085 | 0.670 |
Number of reflections | 22217 | |
<I/σ(I)> | 12.3 | 1.9 |
Completeness [%] | 99.6 | 87 |
Redundancy | 4.6 | 4.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 291 | 100 mM Tris pH 8, 100 mM NaCl, 8 % PEG 20000 |