8SE3

Structure of Full-length Human Protein Kinase C Beta 1 (PKCBI) in the Active Conformation

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-10-10
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.979110
Spacegroup name	C 1 2 1
Unit cell lengths	82.198, 163.158, 77.319
Unit cell angles	90.00, 100.41, 90.00

Refinement procedure

Resolution	48.660 - 2.600
R-factor	0.1986
Rwork	0.197
R-free	0.22730
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.519
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.690
High resolution limit [Å]	2.600	5.600	2.600
Rmerge	0.149	0.084	1.485
Rmeas	0.161	0.091
Rpim	0.061	0.034	0.595
Total number of observations	210297
Number of reflections	30360	3088	3032
<I/σ(I)>	6.5
Completeness [%]	99.5	99.4	99.7
Redundancy	6.9	6.9	7.1
CC(1/2)	0.991	0.993	0.486

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	277.15	PEG3350, sodium citrate