6PW8

Hydrocarbon-Stapled Paxillin Peptide Bound to the Focal Adhesion Targeting (FAT) Domain of the Focal Adhesion Kinase (FAK)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	293
Detector technology	PIXEL
Collection date	2019-04-21
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.02
Spacegroup name	P 21 21 21
Unit cell lengths	47.489, 53.094, 53.419
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.660 - 1.950
R-factor	0.219
Rwork	0.217
R-free	0.24950
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1k05
RMSD bond length	0.010
RMSD bond angle	1.123
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.490	2.020
High resolution limit [Å]	1.950	1.950
Rmerge	0.114	1.859
Number of reflections	10290	1014
<I/σ(I)>	12.8
Completeness [%]	99.7	99.5
Redundancy	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.02 M zinc chloride, 20% PEG3350