6K4R

Crystal structure of SidJ-CaM-AMP ternary complex at 3.11 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	2019-03-22
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97918
Spacegroup name	P 1 21 1
Unit cell lengths	60.846, 159.178, 135.032
Unit cell angles	90.00, 101.78, 90.00

Refinement procedure

Resolution	66.094 - 3.109
R-factor	0.2411
Rwork	0.239
R-free	0.27890
Structure solution method	SAD
RMSD bond length	0.002
RMSD bond angle	0.565
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	132.187	3.280
High resolution limit [Å]	3.109	3.110
Number of reflections	41924	2246
<I/σ(I)>	2
Completeness [%]	99.8
Redundancy	6.5
CC(1/2)	0.997	0.810

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	299	25% PEG 3350, 0.2M NaI, 0.1M HEPES 7.5