7CFI

Structure of the CBS domain of the bacterial CNNM/CorC family Mg2+ transporter in complex with ATP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-10-02
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1
Spacegroup name	F 2 2 2
Unit cell lengths	61.890, 87.300, 201.970
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.650 - 2.450
R-factor	0.2466
Rwork	0.245
R-free	0.25910
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7cfh
RMSD bond length	0.004
RMSD bond angle	0.903
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.18.2_3874: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.650	2.650
High resolution limit [Å]	2.450	2.450
Number of reflections	10115	1293
<I/σ(I)>	14.2
Completeness [%]	98.2
Redundancy	9.5
CC(1/2)	0.998	0.515

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		291	0.1 M CaCl2, 0.1 M HEPES pH 7.5 and 5% PEG 8000