11OT
Crystal Structure of Honey Truffle Active Component 1 through 4 with HEPES bound (Orthorhombic P form)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | BRUKER D8 QUEST |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2025-04-23 |
| Detector | Bruker PHOTON III |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 48.112, 58.915, 84.088 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 25.310 - 1.250 |
| R-factor | 0.1334 |
| Rwork | 0.132 |
| R-free | 0.16430 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.039 |
| Data reduction software | SAINT |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((2.0_5750: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.310 | 1.270 |
| High resolution limit [Å] | 1.250 | 1.250 |
| Rmerge | 0.086 | 1.433 |
| Rmeas | 0.088 | 1.528 |
| Rpim | 0.019 | 0.506 |
| Total number of observations | 1370475 | 26471 |
| Number of reflections | 66898 | 3279 |
| <I/σ(I)> | 26.1 | 1.6 |
| Completeness [%] | 100.0 | |
| Redundancy | 20.5 | 8.1 |
| CC(1/2) | 1.000 | 0.620 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 291 | 10% (w/v) PEG 6000, 100 mM Hepes pH 7.0 |
