4KXI
Crystallographic study of the complex of Ni(II) Schiff base complex and HEW Lysozyme
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2012-02-09 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.5418 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 77.589, 77.589, 36.390 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 25.110 - 2.000 |
R-factor | 0.242 |
Rwork | 0.242 |
R-free | 0.25600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 193l |
RMSD bond length | 0.047 |
RMSD bond angle | 2.500 |
Data reduction software | AUTOMAR |
Phasing software | MOLREP |
Refinement software | CNS (1.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 7791 | |
Completeness [%] | 98.5 | 98.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.8 | 293 | Ni-Schiff-base solution , pH 4.8, VAPOR DIFFUSION, HANGING DROP, temperature 293K |