7AVN

Structure of marine actinobacteria clade rhodopsin (MacR) in orange form in P1 space group

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-12-13
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.97241
Spacegroup name	P 1
Unit cell lengths	40.686, 56.628, 57.386
Unit cell angles	63.66, 78.98, 80.33

Refinement procedure

Resolution	50.570 - 1.600
R-factor	0.1769
Rwork	0.175
R-free	0.20440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5jsi
RMSD bond length	0.006
RMSD bond angle	1.312
Data reduction software	XDS
Data scaling software	Aimless (0.7.4)
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.980	1.630
High resolution limit [Å]	1.600	1.600
Rmerge	0.054	0.892
Rmeas	0.057	0.937
Rpim	0.017	0.284
Total number of observations	641326
Number of reflections	59048	2944
<I/σ(I)>	23.2
Completeness [%]	99.7	99.7
Redundancy	10.9	10.6
CC(1/2)	1.000	0.772

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE		293	1.0 M NH4SO4, 0.1 M NaOAc pH 5.2