6MS8
Crystal Structure of Chalcone Isomerase from Medicago Truncatula Complexed with (2S) Naringenin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.1 |
Synchrotron site | ALS |
Beamline | 8.2.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2018-04-26 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.00000 |
Spacegroup name | P 32 |
Unit cell lengths | 85.090, 85.090, 221.508 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 61.351 - 1.900 |
R-factor | 0.2295 |
Rwork | 0.228 |
R-free | 0.24070 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 73.690 | 1.930 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.076 | 0.300 |
Rpim | 0.300 | |
Number of reflections | 139011 | 6378 |
<I/σ(I)> | 16.2 | |
Completeness [%] | 98.3 | 90.6 |
Redundancy | 4.8 | 1.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277.15 | 30% (v/v) PEG1K, 100 mM Tris (pH 8.5) and 50 mM sodium malonate |