7QJJ

X-Ray Structure of a Mn2+ soak of EleNRMT in complex with two Nanobodies at 4.6A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	80
Detector technology	PIXEL
Collection date	2021-03-27
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	1.892738
Spacegroup name	P 1 21 1
Unit cell lengths	92.900, 115.930, 148.660
Unit cell angles	90.00, 107.59, 90.00

Refinement procedure

Resolution	12.000 - 4.600
R-factor	0.2863
Rwork	0.284
R-free	0.32740
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDBID 7QIA
RMSD bond length	0.003
RMSD bond angle	0.604
Data reduction software	XDS (Version Feb5, 2021)
Data scaling software	XSCALE (Version Feb5, 2021)
Phasing software	PHENIX (1.20_4459)
Refinement software	PHENIX (1.20_4459)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	12.000	4.700
High resolution limit [Å]	4.600	4.600
Rmeas	0.144	1.474
Number of reflections	32816	2039
<I/σ(I)>	11.42	1.85
Completeness [%]	99.7
Redundancy	14
CC(1/2)	1.000	0.910

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277.17	50 mM MgAc, 50 mM HEPES pH 7.2-7.6 and 25-30% PEG400 and crystals soaked in 25mM MnAc