5LVJ
Hen Egg White Lysozyme co-crystallized with [H2Ind][trans-RuCl4(DMSO)(HInd)]
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SEALED TUBE |
Source details | OXFORD DIFFRACTION ENHANCE ULTRA |
Temperature [K] | 120 |
Detector technology | CCD |
Collection date | 2015-05-07 |
Detector | AGILENT ATLAS CCD |
Wavelength(s) | 1.5418 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 77.609, 77.609, 37.205 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 14.830 - 1.600 |
R-factor | 0.1731 |
Rwork | 0.171 |
R-free | 0.21380 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1h87 |
RMSD bond length | 0.019 |
RMSD bond angle | 1.828 |
Data reduction software | CrysalisPro |
Data scaling software | Aimless (0.2.8) |
Phasing software | PHASER (2.5.5) |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 15.220 | 15.220 | 1.520 |
High resolution limit [Å] | 1.500 | 8.210 | 1.500 |
Rmerge | 0.131 | 0.032 | 0.250 |
Number of reflections | 18789 | ||
<I/σ(I)> | 9.9 | ||
Completeness [%] | 99.8 | 83.5 | 97.2 |
Redundancy | 5.9 | 5.3 | 4.1 |
CC(1/2) | 0.996 | 0.997 | 0.228 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 298 | 0.8 M NaCl, 50 mM sodium acetate |