6QSA

Cryogenic temperature structure of blue light-irradiated AtPhot2LOV2 recorded after an accumulated dose of 48 kGy

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-02-02
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.976
Spacegroup name	P 43 21 2
Unit cell lengths	40.324, 40.324, 131.281
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.550 - 1.700
R-factor	0.19088
Rwork	0.190
R-free	0.21629
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4eep
RMSD bond length	0.005
RMSD bond angle	1.642
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.550	1.760
High resolution limit [Å]	1.700	1.700
Number of reflections	12659	1199
<I/σ(I)>	10.39	1.73
Completeness [%]	99.8	98.8
Redundancy	6.24	6.45
CC(1/2)	0.998	0.791

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	293	12-17% PEG8000 0.2 M Calcium Acetate 0.1 M MES