4BUO

High Resolution Structure of Thermostable Agonist-bound Neurotensin Receptor 1 Mutant without Lysozyme Fusion

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-08-06
Detector	DECTRIS PILATUS
Spacegroup name	P 21 21 21
Unit cell lengths	63.310, 89.400, 212.130
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.821 - 2.750
R-factor	0.249
Rwork	0.248
R-free	0.27280
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3zev
RMSD bond length	0.003
RMSD bond angle	0.653
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((PHENIX.REFINE))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.840
High resolution limit [Å]	2.750	2.750
Rmerge	0.080
Number of reflections	32141
<I/σ(I)>	19.85	0.45
Completeness [%]	99.9	88.7
Redundancy	13.1	13.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		9.4		21.5% (V/V) PEG600, 2 M NACL, 50 MM GLYCINE PH 9.4