8OI3

Structure of NopD with AtSUMO2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-10-27
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97918
Spacegroup name	P 21 21 21
Unit cell lengths	80.851, 86.826, 90.485
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.520 - 1.500
R-factor	0.1797
Rwork	0.178
R-free	0.20420
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	alphafold model
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.522	1.634
High resolution limit [Å]	1.499	1.499
Number of reflections	76890	3844
<I/σ(I)>	13.8
Completeness [%]	92.6
Redundancy	6.1
CC(1/2)	0.999	0.497

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1M Imidazole 7.0, 50% v/v MPD