4BWB

Structure of Evolved Agonist-bound Neurotensin Receptor 1 Mutant without Lysozyme Fusion

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Detector	DECTRIS PILATUS 6M
Spacegroup name	P 21 21 21
Unit cell lengths	60.880, 90.890, 211.010
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	21.880 - 3.570
R-factor	0.311
Rwork	0.309
R-free	0.34490
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4buo
RMSD bond length	0.003
RMSD bond angle	0.777
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	3.700
High resolution limit [Å]	3.560	3.560
Rmerge	0.110
Number of reflections	14522
<I/σ(I)>	8.88	0.32
Completeness [%]	99.7	98.4
Redundancy	7.2	7.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		5.5		20% (V/V) PEG600, 0.2 M CACL2, 50 MM NAACETATE PH 5.5