7W5I
The structure of trichobrasilenol synthase TaTC6 in complex with FPP-1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | LIQUID ANODE |
| Source details | BRUKER METALJET |
| Temperature [K] | 100 |
| Detector technology | CMOS |
| Collection date | 2021-07-25 |
| Detector | BRUKER PHOTON 100 |
| Wavelength(s) | 1.34138 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.638, 98.336, 72.379 |
| Unit cell angles | 90.00, 94.65, 90.00 |
Refinement procedure
| Resolution | 33.300 - 2.130 |
| R-factor | 0.2023 |
| Rwork | 0.201 |
| R-free | 0.23090 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4okm |
| Data reduction software | SAINT |
| Data scaling software | SAINT |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.17.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.300 | 2.160 |
| High resolution limit [Å] | 2.130 | 2.130 |
| Rmerge | 0.109 | 0.281 |
| Number of reflections | 91204 | 1664 |
| <I/σ(I)> | 8.6 | 3.3 |
| Completeness [%] | 98.3 | 95.9 |
| Redundancy | 4 | 3 |
| CC(1/2) | 1.000 | 0.920 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | EVAPORATION | 298 | 1.2 M Sodium malonate, pH 6.0 |
