7C6F

Crystal structure of beta-glycosides-binding protein (W177X) of ABC transporter in an open state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2019-04-09
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	P 21 21 21
Unit cell lengths	58.210, 63.100, 103.790
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	53.920 - 1.700
R-factor	0.1759
Rwork	0.174
R-free	0.21580
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7c63
RMSD bond length	0.014
RMSD bond angle	1.909
Data reduction software	MOSFLM (7.2.2)
Data scaling software	Aimless (0.7.4)
Phasing software	PHASER (2.8.3)
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	53.920	53.920	1.730
High resolution limit [Å]	1.700	9.000	1.700
Rmerge	0.086	0.091	0.372
Rmeas	0.093	0.099	0.405
Rpim	0.035	0.039	0.156
Total number of observations	278893	2014	12758
Number of reflections	41913	355	2061
<I/σ(I)>	14.5	22.7	4.2
Completeness [%]	98.1	99.9	94
Redundancy	6.7	5.7	6.2
CC(1/2)	0.995	0.991	0.922

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.2 M Ammonium sulphate, 30% PEG 8000