7E9W
The Crystal Structure of D-psicose-3-epimerase from Biortus.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-02-05 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.5215 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 79.134, 116.083, 91.817 |
Unit cell angles | 90.00, 105.08, 90.00 |
Refinement procedure
Resolution | 48.607 - 2.100 |
Rwork | 0.174 |
R-free | 0.20580 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3vni |
RMSD bond length | 0.004 |
RMSD bond angle | 1.220 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.607 | 2.140 |
High resolution limit [Å] | 2.100 | 2.100 |
Number of reflections | 91449 | 4468 |
<I/σ(I)> | 10.2 | |
Completeness [%] | 98.0 | |
Redundancy | 3.4 | |
CC(1/2) | 0.998 | 0.829 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.02M MgCl2, 0.1M HEPES pH7.5, 22% Polyacrylic acid sodium salt 5,100 |