6A33

Binding and Enhanced Binding between Key Immunity Proteins TRAF6 and TIFA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	CCD
Collection date	2017-11-07
Detector	RAYONIX MX-225
Wavelength(s)	1
Spacegroup name	P 61 2 2
Unit cell lengths	51.430, 51.430, 336.570
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	41.397 - 2.100
R-factor	0.1963
Rwork	0.194
R-free	0.24680
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5zuj
RMSD bond length	0.006
RMSD bond angle	0.845
Data reduction software	XDS
Data scaling software	XSCALE
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.400	2.175
High resolution limit [Å]	2.100	2.100
Rmerge	0.020	0.351
Rmeas	0.028	0.497
Rpim	0.020	0.351
Number of reflections	16418	1576
<I/σ(I)>	16.43
Completeness [%]	98.4	97.4
Redundancy	1.99963	2
CC(1/2)	1.000	0.827

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	7.5	277	0.1 M HEPES sodium, pH 7.5, 1M Sodium citrate tribasic dihydrate, and 10 mM TCEP