7VCG

Thaumatin protected by alginate gel

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AichiSR BEAMLINE BL2S1
Synchrotron site	AichiSR
Beamline	BL2S1
Temperature [K]	95
Detector technology	CCD
Collection date	2021-07-21
Detector	ADSC QUANTUM 270
Wavelength(s)	1.12
Spacegroup name	P 41 21 2
Unit cell lengths	57.945, 57.945, 150.235
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.970 - 1.250
R-factor	0.1485
Rwork	0.148
R-free	0.16160
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ald
RMSD bond length	0.005
RMSD bond angle	0.818
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.910	1.290
High resolution limit [Å]	1.250	1.250
Rmerge	0.222	0.937
Rmeas	0.240	0.973
Rpim	0.064	0.262
Number of reflections	71712	7048
<I/σ(I)>	21.5
Completeness [%]	100.0	100
Redundancy	13.9	13.7
CC(1/2)	0.987	0.785

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	COUNTER-DIFFUSION	7.5	293	1 M sodium tartrate, 0.1 M HEPES