5ZXD

Crystal structure of ATP-bound human ABCF1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	80
Detector technology	CCD
Collection date	2015-03-17
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9754
Spacegroup name	P 21 21 21
Unit cell lengths	66.068, 132.814, 148.329
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.420 - 2.288
R-factor	0.1947
Rwork	0.194
R-free	0.22410
Structure solution method	SAD
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX (1.13-2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.420	2.370
High resolution limit [Å]	2.288	2.288
Rmerge	0.116	0.834
Rmeas	0.121	0.894
Rpim	0.034	0.307
Number of reflections	58677	4857
<I/σ(I)>	17.05
Completeness [%]	98.3	82.93
Redundancy	12.6	7.4
CC(1/2)	0.998	0.750

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289.15	potassium thiocyanate, PEG 3350, sodium citrate, glycerol