3F3Z
Crystal structure of Cryptosporidium parvum calcium dependent protein kinase cgd7_1840 in presence of indirubin E804
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E+ SUPERBRIGHT |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-08-01 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.54 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 63.316, 82.864, 62.151 |
| Unit cell angles | 90.00, 111.61, 90.00 |
Refinement procedure
| Resolution | 57.830 - 1.840 |
| R-factor | 0.189 |
| Rwork | 0.187 |
| R-free | 0.23000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2qg5 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.501 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.910 |
| High resolution limit [Å] | 1.840 | 1.840 |
| Rmerge | 0.054 | 0.606 |
| Number of reflections | 25653 | |
| <I/σ(I)> | 2.5 | |
| Completeness [%] | 99.2 | 95.7 |
| Redundancy | 3.7 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293 | 18% PEG 3350, 0.1 M NH4SO4, 0.1 M NaCacodylate, 5 mM Indirubin E804, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
