7CNG

Structure of CDK5R1 bound FEM1B

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-07-20
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9791
Spacegroup name	P 4 21 2
Unit cell lengths	126.812, 126.812, 144.489
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.900 - 3.490
R-factor	0.2251
Rwork	0.220
R-free	0.26720
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6lbf
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX (1.17.1_3660)
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.630
High resolution limit [Å]	3.490	3.490
Rmerge	0.047	2.271
Number of reflections	15530	1510
<I/σ(I)>	24.5
Completeness [%]	100.0
Redundancy	25.5
CC(1/2)	1.000	0.725

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	1.6M Magnesium sulfate hydrate, 0.1M BIS-TRIS propane pH 6.7