6LNM

Crystal structure of CASK-CaMK in complex with Mint1-CID

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-10-23
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97853
Spacegroup name	P 31
Unit cell lengths	151.417, 151.417, 49.455
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	41.400 - 2.400
R-factor	0.1734
Rwork	0.171
R-free	0.21290
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3tac
RMSD bond length	0.009
RMSD bond angle	1.612
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.440
High resolution limit [Å]	2.400	6.510	2.400
Rmerge	0.167	0.056	0.992
Rmeas	0.178	0.059	1.057
Rpim	0.058	0.018	0.358
Total number of observations	454664
Number of reflections	49568	2495	2468
<I/σ(I)>	3.4
Completeness [%]	99.5	99.4	99.3
Redundancy	9.2	10	8.6
CC(1/2)		0.998	0.546

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	6	289	0.1M BisTris (pH 6.0), 20% PEG 1500