6FJ3

High resolution crystal structure of parathyroid hormone 1 receptor in complex with a peptide agonist.

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
Collection date	2017-09-04
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.000
Spacegroup name	P 1
Unit cell lengths	44.115, 52.864, 111.874
Unit cell angles	80.63, 83.76, 79.16

Refinement procedure

Resolution	49.386 - 2.500
R-factor	0.211
Rwork	0.209
R-free	0.24830
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5ee7 3c4m
RMSD bond length	0.002
RMSD bond angle	0.506
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.390	2.600
High resolution limit [Å]	2.500	2.500
Rmerge	0.153	1.662
Rpim	0.103	1.214
Number of reflections	33759	3825
<I/σ(I)>	5.2	0.9
Completeness [%]	99.8	99.3
Redundancy	5.3	4.7
CC(1/2)	0.994	0.501

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE	6	293	0.1 M sodium citrate pH 6.0, 0.3 M sodium acetate, 31% PEG400, 20 uM E-PTH(1-34)