8OW4
2.75 angstrom crystal structure of human NFAT1 with bound DNA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-06-04 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.979181 |
Spacegroup name | I 1 2 1 |
Unit cell lengths | 101.497, 94.426, 129.449 |
Unit cell angles | 90.00, 93.57, 90.00 |
Refinement procedure
Resolution | 82.242 - 2.750 |
Rwork | 0.216 |
R-free | 0.27280 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.835 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0349) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 82.242 | 2.880 |
High resolution limit [Å] | 2.750 | 2.750 |
Rmerge | 0.067 | 0.506 |
Rmeas | 0.088 | 0.665 |
Rpim | 0.056 | 0.427 |
Number of reflections | 30970 | 4185 |
<I/σ(I)> | 10.5 | 2.1 |
Completeness [%] | 97.3 | 99.9 |
Redundancy | 4.3 | 4.3 |
CC(1/2) | 0.996 | 0.863 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 295 | 0.1 M sodium cacodylate pH 6.0, 8% w/v PEG 8000 |