8P35

Mutant human titin immunoglobulin-like 21 domain - C3575S

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P13 (MX1)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-06-05
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.980
Spacegroup name	P 21 21 21
Unit cell lengths	36.185, 64.892, 288.038
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.210 - 2.200
Rwork	0.220
R-free	0.25000
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX (1.17.1_3660)
Refinement software	PHENIX (1.18.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.210	2.270
High resolution limit [Å]	2.200	2.200
Rmerge	0.080	0.400
Rpim	0.024	0.116
Number of reflections	35855	3088
<I/σ(I)>	22.6
Completeness [%]	100.0	100
Redundancy	24.5
CC(1/2)	0.995	0.984

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	0.1 M HEPES sodium salt, pH 7.5, 25 %(w/v) PEG 2000 MME