6YGN

Titin kinase and its flanking domains

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-04-05
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.91730
Spacegroup name	P 1 21 1
Unit cell lengths	63.640, 184.730, 66.110
Unit cell angles	90.00, 116.60, 90.00

Refinement procedure

Resolution	29.820 - 2.400
R-factor	0.1744
Rwork	0.172
R-free	0.22770
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1tki 2nzi 2bk8
RMSD bond length	0.008
RMSD bond angle	0.920
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.820	2.500
High resolution limit [Å]	2.400	2.400
Number of reflections	52256	6041
<I/σ(I)>	9.74
Completeness [%]	97.9
Redundancy	3.45
CC(1/2)	0.991	0.693

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.15	30% PEG 8K, 0.1 MES pH6.5