3MA6
Crystal structure of kinase domain of TgCDPK1 in presence of 3BrB-PP1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-B |
| Synchrotron site | APS |
| Beamline | 23-ID-B |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-03-15 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | .97948 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 50.329, 145.923, 52.111 |
| Unit cell angles | 90.00, 99.63, 90.00 |
Refinement procedure
| Resolution | 34.740 - 2.500 |
| R-factor | 0.257 |
| Rwork | 0.255 |
| R-free | 0.28600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (2.1.4) |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.540 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.077 | 0.895 |
| Number of reflections | 25594 | |
| <I/σ(I)> | 9.2 | 1.6 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 3.9 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 20% PEG 3350, 0.2 M Ammonium Formate, 15% ethylene glycol, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
