5YZ7
Crystal structure of OsD14 in complex with D-ring-opened 7'-carba-4BD
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2016-01-20 |
Detector | RIGAKU RAXIS VII |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.501, 88.795, 118.600 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.543 - 1.898 |
R-factor | 0.1911 |
Rwork | 0.189 |
R-free | 0.22730 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3vxk |
RMSD bond length | 0.005 |
RMSD bond angle | 0.862 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.010 |
High resolution limit [Å] | 1.898 | 1.900 |
Rmerge | 0.054 | 0.238 |
Number of reflections | 76731 | |
<I/σ(I)> | 38.8 | 12.2 |
Completeness [%] | 97.1 | 89.4 |
Redundancy | 13.9 | 13.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | PEG 20000, HEPES |