3GIG
Crystal structure of phosphorylated DesKC in complex with AMP-PCP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-12-09 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 94.630, 94.630, 162.460 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 28.846 - 3.502 |
| R-factor | 0.291 |
| Rwork | 0.287 |
| R-free | 0.33500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3EHG and 3EHF |
| RMSD bond length | 0.027 |
| RMSD bond angle | 2.718 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (2009_02_15_2320_3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.846 | 3.600 |
| High resolution limit [Å] | 3.500 | 3.500 |
| Rmerge | 0.047 | 0.319 |
| Number of reflections | 10993 | 864 |
| <I/σ(I)> | 4 | |
| Completeness [%] | 99.2 | 99.3 |
| Redundancy | 3.8 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 9.5 | 291 | PEG3000, MgCl2, CHES, AMP-PCP, pH 9.5, vapor diffusion, hanging drop, temperature 291K |
