6CQB
Crystal Structure of Piper methysticum Chalcone Synthase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-04-13 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9793 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 50.910, 120.570, 125.408 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 62.704 - 2.910 |
| R-factor | 0.2679 |
| Rwork | 0.263 |
| R-free | 0.31620 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | Phyre2 model |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.528 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.12_2829)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 62.704 | 3.014 |
| High resolution limit [Å] | 2.910 | 2.910 |
| Number of reflections | 17602 | |
| <I/σ(I)> | 12.54 | |
| Completeness [%] | 100.0 | |
| Redundancy | 61.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 277.15 | HEPES 100 mM pH 7.0, PEG 6000 10% w/v |
