6KX6
Crystal structure of mouse Cryptochrome 1 in complex with KL101 compound
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-06-30 |
Detector | Bruker DIP-6040 |
Wavelength(s) | 0.9 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 130.701, 143.211, 76.820 |
Unit cell angles | 90.00, 118.71, 90.00 |
Refinement procedure
Resolution | 36.340 - 2.000 |
R-factor | 0.2154 |
Rwork | 0.214 |
R-free | 0.24940 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6kx4 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.607 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 36.920 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.130 | 0.476 |
Rmeas | 0.151 | 0.559 |
Rpim | 0.078 | 0.292 |
Number of reflections | 81644 | 11841 |
<I/σ(I)> | 8.2 | 2.8 |
Completeness [%] | 98.0 | |
Redundancy | 3.7 | |
CC(1/2) | 0.989 | 0.648 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 20% (w/v) PEG3350, 200 mM NH4Cl |