5AZD

Crystal structure of thermophilic rhodopsin.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-1A
Synchrotron site	Photon Factory
Beamline	BL-1A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-10-30
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.1
Spacegroup name	P 1
Unit cell lengths	63.186, 67.693, 73.045
Unit cell angles	116.48, 114.14, 90.82

Refinement procedure

Resolution	46.519 - 2.800
R-factor	0.2311
Rwork	0.228
R-free	0.27770
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ddl
RMSD bond length	0.003
RMSD bond angle	0.737
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.520	2.896
High resolution limit [Å]	2.800	2.796
Rmerge	0.119	0.454
Number of reflections	22122
<I/σ(I)>	6.26	1.77
Completeness [%]	93.2	89.08
Redundancy	1.8	1.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE	3.6	296	100mM sodium citrate pH3.6, 34% PEG 400 (v/v)