1DVI
CALPAIN DOMAIN VI WITH CALCIUM BOUND
Experimental procedure
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X12C |
| Synchrotron site | NSLS |
| Beamline | X12C |
| Temperature [K] | 110 |
| Detector technology | IMAGE PLATE |
| Collection date | 1996-03-08 |
| Detector | MARRESEARCH |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 75.000, 87.400, 118.300 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 8.000 - 2.300 |
| R-factor | 0.206 |
| Rwork | 0.206 |
| R-free | 0.29400 |
| Structure solution method | MAD |
| RMSD bond length | 0.011 |
| RMSD bond angle | 20.300 * |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | X-PLOR (3.843) |
| Refinement software | X-PLOR (3.843) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.000 | 2.380 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.037 | 0.100 |
| Total number of observations | 57387 * | |
| Number of reflections | 16358 | |
| <I/σ(I)> | 17.6 | |
| Completeness [%] | 93.6 | 85.5 |
| Redundancy | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | unknown * | 6.5 | 17% PEG 8K, 50MM CACODYLATE PH. 6.5 , 10% GLYCEROL, 200MM CACL2 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | 1 | PEG8000 | 17 (%) | |
| 2 | 1 | 1 | cacodylate | 50 (mM) | |
| 3 | 1 | 1 | glycerol | 10 (%) | |
| 4 | 1 | 1 | 200 (mM) |
