7YH3

TRAPPC3 from Thorarchaeota SMTZ1-45

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE TPS 05A
Synchrotron site	NSRRC
Beamline	TPS 05A
Temperature [K]	100
Detector technology	CCD
Collection date	2019-04-06
Detector	RAYONIX MX300-HS
Wavelength(s)	1
Spacegroup name	P 1 21 1
Unit cell lengths	68.387, 62.060, 69.324
Unit cell angles	90.00, 100.46, 90.00

Refinement procedure

Resolution	19.480 - 1.700
R-factor	0.2185
Rwork	0.216
R-free	0.25840
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7yh2
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	1.730
High resolution limit [Å]	1.700	1.700
Rmerge	0.048	0.351
Rmeas	0.056	0.351
Rpim	0.028	0.177
Number of reflections	51122	2550
<I/σ(I)>	22.9	2.2
Completeness [%]	94.9
Redundancy	3.8
CC(1/2)		0.932

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	00 mM HEPES pH 7.5 250 mM Mg(HCO2)2 18% PEG 3350