8E19

Crystal structure of TnmK1 complexed with TNM H

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2019-12-10
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5400
Spacegroup name	P 41 21 2
Unit cell lengths	85.843, 85.843, 129.317
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.550 - 2.030
R-factor	0.1826
Rwork	0.181
R-free	0.20620
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8e18
RMSD bond length	0.006
RMSD bond angle	0.835
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.060
High resolution limit [Å]	2.030	2.030
Number of reflections	31893	1569
<I/σ(I)>	32
Completeness [%]	100.0
Redundancy	13.2
CC(1/2)	0.998	0.728

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	298	0.1 M HEPES, pH 7.0, 1.0 M succinic acid, pH 7.0, and 1% w/v PEG 2000 MME