6QGS

Crystal structure of APT1 bound to palmitic acid.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-11-19
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	0.82656
Spacegroup name	P 41 21 2
Unit cell lengths	81.660, 81.660, 441.946
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.948 - 2.755
R-factor	0.186
Rwork	0.184
R-free	0.23010
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1fj2
RMSD bond length	0.003
RMSD bond angle	0.549
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.14_3260?))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.950	2.920
High resolution limit [Å]	2.755	2.755
Rmerge	0.130
Number of reflections	73690
<I/σ(I)>	20
Completeness [%]	99.7
Redundancy	14

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	10% of polyethylene glycol (PEG) 8000, 0.2 M potassium bromide, 01.M sodium acetate at pH 5.5,10%w/v PEG1000