5JSJ
Crystal structure of Spindlin1 bound to compound EML631
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL18U1 |
Synchrotron site | SSRF |
Beamline | BL18U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-05-08 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9778 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 42.790, 123.827, 49.663 |
Unit cell angles | 90.00, 92.22, 90.00 |
Refinement procedure
Resolution | 42.758 - 2.348 |
R-factor | 0.2013 |
Rwork | 0.199 |
R-free | 0.24880 |
RMSD bond length | 0.009 |
RMSD bond angle | 0.946 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | PHENIX (dev_2689: ???) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.400 |
High resolution limit [Å] | 2.350 | 5.790 | 2.350 |
Rmerge | 0.092 | 0.067 | 0.318 |
Number of reflections | 21323 | ||
<I/σ(I)> | 6.3 | ||
Completeness [%] | 98.9 | 99.6 | 89.9 |
Redundancy | 5.4 | 5.5 | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | 0.2M MgCl2, 0.1M HepesNa, 25% PEG 3350 |