4W96
Crystal structure of cross-linked tetragonal hen egg white lysozyme soaked with 5mM [Ru(CO)3Cl2]2 followed by the reaction in deoxy-myoglobin solution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL38B1 |
Synchrotron site | SPring-8 |
Beamline | BL38B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-12-20 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.0000 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 79.011, 79.011, 36.994 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.840 - 1.500 |
R-factor | 0.1961 |
Rwork | 0.195 |
R-free | 0.22660 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.025 |
RMSD bond angle | 2.154 |
Data reduction software | SCALEPACK |
Data scaling software | MOLREP |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.000 | 1.540 |
High resolution limit [Å] | 1.500 | 1.500 |
Number of reflections | 17128 | |
<I/σ(I)> | 58.8 | |
Completeness [%] | 93.5 | 99.14 |
Redundancy | 11.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 293 | NaCl, sodium acetate |