8WDW
Crystal structure of a novel PU plastic degradation urethanase UMG-SP2 from uncultured bacterium
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-09-07 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.987 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 88.430, 88.430, 277.780 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.220 - 2.160 |
R-factor | 0.1664 |
Rwork | 0.164 |
R-free | 0.20660 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.003 |
RMSD bond angle | 0.604 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.21_5207: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.220 |
High resolution limit [Å] | 2.160 | 2.160 |
Number of reflections | 59940 | 4311 |
<I/σ(I)> | 12.98 | 1.88 |
Completeness [%] | 99.7 | |
Redundancy | 13.6 | 11.4 |
CC(1/2) | 0.998 | 0.831 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | MgCl2, Tris, PEG4000 |