7D2P

Crystal structure of MazE-MazF (Form-II) from Deinococcus radiodurans

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	193
Detector technology	CCD
Collection date	2017-10-02
Detector	ADSC QUANTUM 270
Wavelength(s)	0.97935
Spacegroup name	P 1
Unit cell lengths	39.824, 42.327, 64.998
Unit cell angles	96.51, 97.82, 86.71

Refinement procedure

Resolution	29.400 - 2.070
R-factor	0.173
Rwork	0.168
R-free	0.23100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7d28
RMSD bond length	0.009
RMSD bond angle	1.545
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.030
High resolution limit [Å]	2.000	5.430	2.000
Rmerge	0.063	0.034	0.365
Rmeas	0.074	0.041	0.424
Rpim	0.038	0.022	0.215
Total number of observations	104692
Number of reflections	28134	1329	1411
<I/σ(I)>	8.4
Completeness [%]	97.2	91.9	96.2
Redundancy	3.7	3.3	3.9
CC(1/2)		0.992	0.902

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M succinic acid pH 7.0 and 12% w/v PEG 3,350