7BUU
Eucommia ulmoides TPT3, crystal form 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-11-06 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 1.0 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 80.260, 80.260, 278.950 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.440 - 3.000 |
R-factor | 0.2228 |
Rwork | 0.222 |
R-free | 0.23290 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4kk2 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.239 |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.440 | 3.107 |
High resolution limit [Å] | 3.000 | 3.000 |
Number of reflections | 19181 | 1849 |
<I/σ(I)> | 24.7 | |
Completeness [%] | 99.9 | |
Redundancy | 28.6 | |
CC(1/2) | 1.000 | 0.790 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | PEG 3350, DL-Malic acid, Risedronate, MgCl2 |