9GK0

Human SMUG1 in complex with uracil

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	MAX IV BEAMLINE BioMAX
Synchrotron site	MAX IV
Beamline	BioMAX
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-06-07
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.6491
Spacegroup name	P 21 21 21
Unit cell lengths	49.052, 60.703, 91.994
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	22.510 - 0.950
R-factor	0.136
Rwork	0.136
R-free	0.14570
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.945
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.21.1_5286)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.370	0.970
High resolution limit [Å]	0.950	0.950
Number of reflections	172475	8380
<I/σ(I)>	12.4
Completeness [%]	99.8
Redundancy	26.4
CC(1/2)	0.998	0.442

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		294	0.1 M Buffer System 3 pH 8.4, 80 % (v/v) P500MME_P20K, 0.12 M Alcohols Mix (Morpheus Screen, Molecular Dimensions)