4YHS

CRYSTAL STRUCTURE OF AN ABC TRANSPORTER SOLUTE BINDING PROTEIN (IPR025997) FROM BRADYRHIZOBIUM sp. BTAi1 (BBta_2440, TARGET EFI-511490) WITH BOUND BIS-TRIS

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 31-ID
Synchrotron site	APS
Beamline	31-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2015-02-11
Detector	RAYONIX MX225HE
Wavelength(s)	0.9793
Spacegroup name	P 32 2 1
Unit cell lengths	101.820, 101.820, 76.854
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	24.601 - 1.800
R-factor	0.1837
Rwork	0.181
R-free	0.22660
Structure solution method	SAD
RMSD bond length	0.011
RMSD bond angle	1.284
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	HKL-3000
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	100.000	100.000	1.830
High resolution limit [Å]	1.800	4.890	1.800
Rmerge	0.098	0.044	0.906
Rmeas	0.101	0.045	0.932
Rpim	0.022	0.010	0.214
Total number of observations	861431
Number of reflections	42874
<I/σ(I)>	7.4
Completeness [%]	99.5	97.4	98.1
Redundancy	20.1	20.8	18.1
CC(1/2)		0.999	0.913

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	298	Protein (10 mM HEPES pH 7.5, 5 mM DTT); Reservoir (MCSG1 H9)(0.1 M Bis-Tris pH 5.5, 25%(w/v) PEG 3350); Cryoprotection (80% (50% Peg3350), 20% Reservoir)