6AMB

Crystal Structure of the Afadin RA1 domain in complex with HRAS

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2013-06-28
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97929
Spacegroup name	P 21 21 21
Unit cell lengths	48.239, 57.152, 73.329
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.301 - 2.500
R-factor	0.2232
Rwork	0.218
R-free	0.26550
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ddc
RMSD bond length	0.002
RMSD bond angle	0.522
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.540
High resolution limit [Å]	2.500	6.780	2.500
Rmerge	0.097	0.069	0.557
Rmeas	0.106	0.076	0.609
Rpim	0.041	0.031	0.241
Number of reflections	7437	427	358
<I/σ(I)>	8.6
Completeness [%]	99.9	98.8	100
Redundancy	6.9	5.9	6.2
CC(1/2)		0.996	0.853

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	8.9	297	PEG3350, K2HPO4