9J9C
Glucosyl transferase NbUGT72AY1 co-crystallized with Scopoletin and UDP2Fglucose in the presence of retinol
Replaces: 8J2SExperimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 2 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-12-10 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.987 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 87.130, 170.390, 152.130 |
Unit cell angles | 90.00, 93.39, 90.00 |
Refinement procedure
Resolution | 48.530 - 3.100 |
R-factor | 0.25939 |
Rwork | 0.256 |
R-free | 0.31784 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 8j2v |
RMSD bond length | 0.007 |
RMSD bond angle | 2.016 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0419) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.530 | 3.210 |
High resolution limit [Å] | 3.100 | 3.100 |
Number of reflections | 79381 | 253 |
<I/σ(I)> | 6.7 | 0.4 |
Completeness [%] | 78.4 | |
Redundancy | 7.1 | |
CC(1/2) | 0.994 | 0.100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 298 | 0.1 M Magnesium acetate tetrahydrate, 0.1 M Sodium cacodylate pH 6.5, 15% w/v PEG 6000 |