7EJO

Structure of ERH-2 bound to TOST-1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	CCD
Collection date	2020-10-23
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9791
Spacegroup name	P 21 21 2
Unit cell lengths	103.117, 51.882, 57.038
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	25.941 - 2.191
R-factor	0.1823
Rwork	0.178
R-free	0.22350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1wz7
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.280
High resolution limit [Å]	2.190	2.190
Number of reflections	22224	1744
<I/σ(I)>	34
Completeness [%]	100.0
Redundancy	11.4
CC(1/2)	1.000	0.924

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.1M Bis-tris pH 6.2, tascimate pH 6.0 20%