6XY3
2.0 Angstrom crystal structure of Ca/CaM N53I:RyR2 peptide complex
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-04-16 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97624 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 39.010, 42.700, 89.360 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.720 - 2.000 |
| Rwork | 0.208 |
| R-free | 0.25970 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6xxf |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.457 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 89.360 | 2.050 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.100 | 0.368 |
| Rmeas | 0.122 | 0.450 |
| Rpim | 0.069 | 0.256 |
| Number of reflections | 10637 | 778 |
| <I/σ(I)> | 8.9 | 3.8 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 5.3 | 5.4 |
| CC(1/2) | 0.994 | 0.908 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M Sodium acetate trihydrate pH 4.5, 10% w/v Polyethylene glycol 10,000 |
