9QJ2

Titin kinase (isoform b) from medaka

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P14 (MX2)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-03-15
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.9763
Spacegroup name	P 1 21 1
Unit cell lengths	61.735, 56.080, 120.245
Unit cell angles	90.00, 104.28, 90.00

Refinement procedure

Resolution	29.910 - 2.100
R-factor	0.1914
Rwork	0.190
R-free	0.22730
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.897
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.150
High resolution limit [Å]	2.100	2.100
Number of reflections	46545	3175
<I/σ(I)>	10.55	0.91
Completeness [%]	99.2	99.2
Redundancy	6.88
CC(1/2)	0.988	0.370

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.15	20% [w/v] PEG 8000, 100 mM HEPES pH 7.5