4XP5

X-ray structure of Drosophila dopamine transporter bound to cocaine analogue-RTI55

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	2014-02-22
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.00
Spacegroup name	P 21 21 21
Unit cell lengths	95.250, 137.980, 163.390
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.280 - 3.300
R-factor	0.2469
Rwork	0.245
R-free	0.28590
RMSD bond length	0.002
RMSD bond angle	0.697
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	3.300
Number of reflections	28495
<I/σ(I)>	11
Completeness [%]	86.2
Redundancy	4.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	PEG 400 (41%), Tris (0.1M)