4K8O

CRYSTAL STRUCTURE OF THE ATPASE DOMAIN OF TAP1 WITH ATP (D645N, D651A MUTANT)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	93
Detector technology	PIXEL
Collection date	2012-10-10
Detector	PSI PILATUS 6M
Wavelength(s)	0.97920
Spacegroup name	C 2 2 21
Unit cell lengths	54.260, 123.980, 79.910
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.980 - 2.650
R-factor	0.2497
Rwork	0.248
R-free	0.27020
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.715
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.2_1309))

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.650

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	277	0.85M Sodium tricitrate, 100mM Tris pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 277K