6FXG

Crystal structure of substrate binding domain 1 (SBD1) OF ABC transporter GLNPQ in complex with Asparagine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-10-31
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	1
Spacegroup name	P 1 21 1
Unit cell lengths	41.870, 74.270, 110.240
Unit cell angles	90.00, 90.55, 90.00

Refinement procedure

Resolution	44.260 - 1.700
R-factor	0.138
Rwork	0.136
R-free	0.17000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4kpt
RMSD bond length	0.009
RMSD bond angle	0.981
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.261	1.720
High resolution limit [Å]	1.700	1.700
Rmeas	0.040	0.101
Number of reflections	135138
<I/σ(I)>	15.2
Completeness [%]	92.5	74
Redundancy	1.84

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	4.5	273	0.1M CH3COONa pH4.5, 0.05 M (CH3COO)Ca2, 40 % v/v propanediol