8HJL
Crystal structure of glycosyltransferase SgUGT94-289-3 in complex with M3E
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-12-20 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.97918 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 78.633, 76.161, 82.254 |
Unit cell angles | 90.00, 92.59, 90.00 |
Refinement procedure
Resolution | 24.630 - 1.720 |
R-factor | 0.2125 |
Rwork | 0.210 |
R-free | 0.25520 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6jtd |
RMSD bond length | 0.007 |
RMSD bond angle | 1.079 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.071 |
High resolution limit [Å] | 1.720 | 2.000 |
Number of reflections | 101044 | 5425 |
<I/σ(I)> | 25.55 | |
Completeness [%] | 90.9 | |
Redundancy | 6.5 | |
CC(1/2) | 0.998 | 0.998 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289.15 | Tris-HCl, polyethylene glycol 3350, NaCl, Polypropylene glycol P400. |