7MXH
CD1c with antigen analogue 3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-11-11 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9537 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 55.569, 72.734, 98.922 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.160 - 2.110 |
R-factor | 0.21 |
Rwork | 0.208 |
R-free | 0.25500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7mx4 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.168 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.18.2_3874-000) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.160 | 2.185 |
High resolution limit [Å] | 2.110 | 2.110 |
Rmerge | 0.045 | 0.438 |
Rmeas | 0.064 | 0.619 |
Rpim | 0.045 | 0.438 |
Number of reflections | 23737 | 2342 |
<I/σ(I)> | 8.29 | 1.69 |
Completeness [%] | 99.9 | 99.91 |
Redundancy | 2 | 2 |
CC(1/2) | 0.995 | 0.639 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9.4 | 293 | 100 mM CHES, 1.05 M sodium citrate, 25 mM triglycine |