7MXF
CD1c with antigen analogue 2
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 | 2020-10-09 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9322 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 55.224, 71.363, 100.032 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.670 - 2.000 |
R-factor | 0.2064 |
Rwork | 0.204 |
R-free | 0.24160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7mx4 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.049 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.670 | 2.072 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.027 | 0.329 |
Rmeas | 0.039 | 0.465 |
Rpim | 0.027 | 0.329 |
Number of reflections | 27417 | 2711 |
<I/σ(I)> | 12.26 | 2.04 |
Completeness [%] | 100.0 | 99.96 |
Redundancy | 2 | 2 |
CC(1/2) | 0.999 | 0.779 |
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 |