7VJ6

SFX structure of archaeal class II CPD photolyase from Methanosarcina mazei in the semiquinone state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	FREE ELECTRON LASER
Source details	SACLA BEAMLINE BL2
Synchrotron site	SACLA
Beamline	BL2
Temperature [K]	293
Detector technology	CCD
Collection date	2017-11-09
Detector	MPCCD
Wavelength(s)	1.7712035
Spacegroup name	P 43 21 2
Unit cell lengths	70.550, 70.550, 245.700
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	31.650 - 2.100
R-factor	0.1462
Rwork	0.145
R-free	0.17680
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6IWX
RMSD bond length	0.002
RMSD bond angle	0.396
Data reduction software	CrystFEL (0.6.3)
Data scaling software	CrystFEL (0.6.3)
Phasing software	PHASER (2.8.2)
Refinement software	PHENIX ((1.19_4092: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.320	2.130
High resolution limit [Å]	2.090	2.090
Number of reflections	38983	2081
<I/σ(I)>	5.54	0.49
Completeness [%]	100.0	100
Redundancy	438.4	57.4
CC(1/2)	0.990	0.510

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE	8	277	0.5-0.65 M Li2SO4, 10-15% (W/V) PEG 8000