8DSS

X-ray crystal structure of Geobacillus stearothermophilus ComEA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	297
Detector technology	IMAGE PLATE
Collection date	2021-01-20
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	P 65
Unit cell lengths	80.706, 80.706, 71.279
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	40.350 - 3.050
R-factor	0.2319
Rwork	0.226
R-free	0.28400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8dfk
RMSD bond length	0.003
RMSD bond angle	0.480
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.100
High resolution limit [Å]	3.050	3.050
Number of reflections	5194	273
<I/σ(I)>	9.38
Completeness [%]	99.7
Redundancy	5
CC(1/2)	0.929	0.429

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	293	30% PEG 400, 0.1M ammonium nitrate