4XP1

X-ray structure of Drosophila dopamine transporter bound to neurotransmitter dopamine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	CCD
Collection date	2014-09-21
Detector	ADSC QUANTUM 315
Wavelength(s)	1.00
Spacegroup name	P 21 21 21
Unit cell lengths	96.797, 140.181, 166.195
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.983 - 2.890
R-factor	0.2197
Rwork	0.218
R-free	0.25620
RMSD bond length	0.006
RMSD bond angle	1.059
Data scaling software	Aimless (0.2.17)
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	44.983		3.060
High resolution limit [Å]	2.890	8.540	2.890
Rmerge	0.113	0.023	1.664
Rmeas	0.129	0.027	1.931
Total number of observations	200565
Number of reflections	94660	2043	6706
<I/σ(I)>	11.35	46.38	0.73
Completeness [%]	96.3	94.5	81.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	277	PEG 600 31%, Tris (0.1M)