6PGI

Asymmetric functions of a binuclear metal cluster within the transport pathway of the ZIP transition metal transporters

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-06-30
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.987
Spacegroup name	C 1 2 1
Unit cell lengths	96.782, 61.274, 54.753
Unit cell angles	90.00, 108.80, 90.00

Refinement procedure

Resolution	40.000 - 3.500
R-factor	0.275
Rwork	0.271
R-free	0.32030
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5tsa
RMSD bond length	0.003
RMSD bond angle	0.521
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	3.630
High resolution limit [Å]	3.500	3.500
Number of reflections	310	177225
<I/σ(I)>	6.9
Completeness [%]	97.6
Redundancy	3.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE		294.15	33% (w/v) PEG 400, 100 mM NaCl, 100 mM CdCl2, 100 mM Tris-HCl (pH 7.5)