6X72

Rev1 Mg2+-facilitated Product Complex with two monophosphates

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-03-11
Detector	DECTRIS PILATUS3 R 200K-A
Wavelength(s)	1.54
Spacegroup name	P 21 21 21
Unit cell lengths	62.408, 73.814, 117.147
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.910 - 2.190
R-factor	0.1915
Rwork	0.186
R-free	0.25210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5wm1
RMSD bond length	0.009
RMSD bond angle	1.083
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.910	2.692
High resolution limit [Å]	2.190	2.190
Rmeas	0.115
Number of reflections	38751	11121
<I/σ(I)>	8
Completeness [%]	99.6
Redundancy	3.9
CC(1/2)		0.435

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	15-23% PEG3350 and 200 mM ammonium nitrate