4ZAK
Crystal structure of the mCD1d/DB06-1/iNKTCR ternary complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL11-1 |
Synchrotron site | SSRL |
Beamline | BL11-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-07-17 |
Detector | MARMOSAIC 325 mm CCD |
Wavelength(s) | 0.976 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 78.921, 190.544, 150.760 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.420 - 2.824 |
R-factor | 0.2179 |
Rwork | 0.216 |
R-free | 0.25610 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2q7y |
RMSD bond length | 0.006 |
RMSD bond angle | 0.904 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER (2.3.0) |
Refinement software | REFMAC (5.6.0104) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 150.760 | 2.930 |
High resolution limit [Å] | 2.824 | 2.824 |
Rmerge | 0.573 | |
Number of reflections | 27210 | |
<I/σ(I)> | 10.4 | 1.9 |
Completeness [%] | 98.1 | 98.6 |
Redundancy | 3.9 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5 | 295 | 20% PEG 4000, 0.2M ammonium citrate dibasic |