3S8E
Phosphorylation regulates assembly of the caspase-6 substrate-binding groove
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2010-05-28 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1. |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 81.671, 163.662, 89.015 |
| Unit cell angles | 90.00, 94.17, 90.00 |
Refinement procedure
| Resolution | 29.590 - 2.880 |
| R-factor | 0.2176 |
| Rwork | 0.216 |
| R-free | 0.25646 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2wdp |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.754 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 40.000 | 40.000 | 2.970 |
| High resolution limit [Å] | 2.870 | 6.180 | 2.870 |
| Number of reflections | 47774 | ||
| <I/σ(I)> | 8.4 | ||
| Completeness [%] | 90.5 | 99.5 | 80.6 |
| Redundancy | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.2 | 298 | 0.1M HEPES, 0.1M NaCl, 1.5M Ammonium sulfate, pH 7.2, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
