8S6N

Structure of MLLE3 domain of Rrm4 in complex with PAM2L1 of Upa1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-11-06
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.9253
Spacegroup name	C 2 2 21
Unit cell lengths	74.715, 83.486, 170.398
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.610 - 1.743
Rwork	0.220
R-free	0.24980
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.295
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (v1.17)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.610	1.805
High resolution limit [Å]	1.743	1.743
Number of reflections	54171	4939
<I/σ(I)>	9.06
Completeness [%]	98.9
Redundancy	4.1
CC(1/2)	0.998	0.361

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	3.2 M AmSO4 + 0.1M MES pH 6