1NX0
Structure of Calpain Domain 6 in Complex with Calpastatin DIC
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 103 |
| Detector technology | IMAGE PLATE |
| Detector | RIGAKU RAXIS IV |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 53.780, 83.300, 92.150 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 100.000 - 2.300 |
| R-factor | 0.218 |
| Rwork | 0.218 |
| R-free | 0.21300 * |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 * |
| RMSD bond angle | 1.327 * |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | CNS (0.9) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 100.000 |
| High resolution limit [Å] | 2.300 |
| Rmerge | 0.060 |
| Number of reflections | 18854 |
| <I/σ(I)> | 17.5 |
| Completeness [%] | 98.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | PEG 6000, BME, EDTA, CaCl2, NaCl, pH 5.5, VAPOR DIFFUSION, HANGING DROP |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | CAC | 50 (mM) | |
| 2 | 1 | reservoir | PEG6000 | 20 (%) | |
| 3 | 1 | reservoir | beta-mercaptoethanol | 5 (mM) | |
| 4 | 1 | reservoir | EDTA | 2 (mM) | |
| 5 | 1 | reservoir | 2 (mM) | ||
| 6 | 1 | reservoir | 200 (mM) | ||
| 7 | 1 | drop | protein | 5 (mg/ml) |
