8A1H

Bacterial 6-4 photolyase from Vibrio cholerase

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	2019-11-26
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.00003
Spacegroup name	P 64 2 2
Unit cell lengths	199.687, 199.687, 76.996
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	34.590 - 1.650
R-factor	0.1194
Rwork	0.119
R-free	0.13620
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4dja
RMSD bond length	0.017
RMSD bond angle	1.365
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX (1.20.1_4487)
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	34.600	1.710
High resolution limit [Å]	1.650	1.650
Rmerge	0.061	0.740
Rmeas	0.064	0.785
Rpim	0.019	0.261
Number of reflections	108011	10661
<I/σ(I)>	25.34	2.73
Completeness [%]	100.0	100
Redundancy	11	8.7
CC(1/2)	1.000	0.844

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293	0.1 M Tris pH 8.5, 1.5 ammonium sulfate and 12% (v/v) glycerol, 6.25 mg/ml Vc6-4