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 |