3LLT
Crystal structure of PF14_0431, kinase domain.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-01-23 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | .97949 |
Spacegroup name | P 65 |
Unit cell lengths | 140.081, 140.081, 52.418 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 25.000 - 2.500 |
R-factor | 0.225 |
Rwork | 0.223 |
R-free | 0.26700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1z57 |
RMSD bond length | 0.005 |
RMSD bond angle | 1.008 |
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] | 40.000 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.114 | 0.449 |
Number of reflections | 20417 | |
<I/σ(I)> | 9.6 | 2.19 |
Completeness [%] | 99.3 | 94.6 |
Redundancy | 5.3 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 293 | 1.85 M NH4SO4 0.2 M NaAcet 0.1 M Na Caodylate pH 5.6 5 mM AMPPNP, VAPOR DIFFUSION, SITTING DROP, temperature 293K |