9FZW

Structure of Urethanase UMG-SP2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.2
Synchrotron site	BESSY
Beamline	14.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-04-16
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.918
Spacegroup name	P 43 21 2
Unit cell lengths	88.770, 88.770, 276.440
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	21.710 - 2.590
R-factor	0.2086
Rwork	0.208
R-free	0.23560
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.545
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.21_5207: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.930	2.750
High resolution limit [Å]	2.590	2.590
Number of reflections	65635	10605
<I/σ(I)>	4.7
Completeness [%]	100.0
Redundancy	14.2
CC(1/2)	0.978	0.311

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	7.5	293	0.2M ammonium sulfate, 0.1M HEPES, pH 7.5, 35% (w/v) Poly(acrylic acid sodium salt) 2100