4NL0
Structural and functional characterization of a novel Alpha Kinase in complex with ADP from Entamoeba histolytica
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2013-04-24 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 0.978 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 51.500, 90.030, 123.720 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.890 - 2.410 |
| R-factor | 0.20766 |
| Rwork | 0.206 |
| R-free | 0.23577 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4kuj |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.980 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.890 | 2.540 |
| High resolution limit [Å] | 2.410 | 2.410 |
| Rmerge | 0.093 | 0.357 |
| Number of reflections | 21411 | |
| <I/σ(I)> | 15.6 | 5.4 |
| Completeness [%] | 98.6 | 98.9 |
| Redundancy | 7.4 | 7.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 289 | 25% PEG 1500, Tris pH7.5, 150mM NaCl, VAPOR DIFFUSION, HANGING DROP, temperature 289K |
