6K4L

Crystal structure of Se-labelled SidJ complex with CaM at 2.95 A

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	2018-05-01
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97981
Spacegroup name	P 1 21 1
Unit cell lengths	61.060, 159.246, 135.809
Unit cell angles	90.00, 101.68, 90.00

Refinement procedure

Resolution	68.316 - 2.949
R-factor	0.2439
Rwork	0.243
R-free	0.26860
Structure solution method	SAD
RMSD bond length	0.004
RMSD bond angle	0.872
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	133.000	3.110
High resolution limit [Å]	2.949	2.950
Number of reflections	53504	54886
<I/σ(I)>	2
Completeness [%]	99.9
Redundancy	6.8
CC(1/2)	0.997	0.607

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	299	25% PEG 3350, 0.2M NaI