8S6O

Structure of MLLE3 domain of Rrm4 in complex with PAM2L2 of Upa1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P13 (MX1)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-12-16
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	82.881, 74.633, 168.511
Unit cell angles	90.00, 90.08, 90.00

Refinement procedure

Resolution	56.170 - 2.400
Rwork	0.240
R-free	0.27600
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.025
RMSD bond angle	2.341
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.17)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	56.170	2.486
High resolution limit [Å]	2.400	2.400
Number of reflections	39386	3912
<I/σ(I)>	8.2
Completeness [%]	97.2
Redundancy	3
CC(1/2)	0.997	0.581

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	HEPES pH 7.5, 25% PEG 3000