6KMH

The crystal structure of CASK/Mint1 complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-05-22
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	93.978, 96.321, 97.560
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.232 - 2.400
R-factor	0.19
Rwork	0.188
R-free	0.22410
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3tac
RMSD bond length	0.009
RMSD bond angle	1.231
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.430
High resolution limit [Å]	2.350	5.060	2.350
Rmerge	0.121	0.071	0.518
Rmeas	0.127	0.075	0.545
Rpim	0.040	0.024	0.169
Total number of observations	381609
Number of reflections	37889	3990	3725
<I/σ(I)>	12.1
Completeness [%]	99.9	99.3	100
Redundancy	10.1	9.6	10.2
CC(1/2)		0.997	0.972

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	0.2M KI, 20% PEG 3350, pH 7.0