6CM4

Structure of the D2 Dopamine Receptor Bound to the Atypical Antipsychotic Drug Risperidone

Replaces:  6C38

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-08-13
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.033
Spacegroup name	P 21 21 21
Unit cell lengths	50.979, 72.523, 151.307
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.549 - 2.867
R-factor	0.2271
Rwork	0.226
R-free	0.24920
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB entries 5WIU & 2RH1
RMSD bond length	0.003
RMSD bond angle	0.516
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.990
High resolution limit [Å]	2.867	2.900
Rmerge	0.134	0.738
Number of reflections	12826	889
<I/σ(I)>	15.2	1
Completeness [%]	97.3	86.9
Redundancy	5.5	2.5
CC(1/2)	0.994	0.535

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE		293	100 mM Tris-HCl, pH 7.8, 230 mM lithium nitrate, 25% PEG400, 4% 1,3-butanediol