6LS3

cubic-shaped crystal of TmFtn mutant-T4FY stimulated by Mg

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	273
Detector technology	CCD
Collection date	2019-11-09
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.979
Spacegroup name	H 3 2
Unit cell lengths	171.737, 171.737, 384.289
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	138.703 - 2.815
R-factor	0.1895
Rwork	0.187
R-free	0.24270
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1vlg
RMSD bond length	0.009
RMSD bond angle	0.952
Data reduction software	HKL-3000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	138.703	2.961
High resolution limit [Å]	2.815	2.815
Number of reflections	50424	5252
<I/σ(I)>	4.64
Completeness [%]	95.0
Redundancy	5
CC(1/2)	0.999	0.999

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	100 mM Potassium phosphate monobasic, Sodium phosphate dibasic pH 6.2, and 2500 mM Sodium chloride, 60 mM MgCl2