10SB

PCSK9 in complex with cyclic peptide 21

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-08-31
Detector	PSI PILATUS 6M
Wavelength(s)	0.99997
Spacegroup name	P 32 2 1
Unit cell lengths	70.741, 70.741, 159.125
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	24.270 - 1.828
R-factor	0.1985
Rwork	0.196
R-free	0.23850
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.008
RMSD bond angle	0.990
Data reduction software	XDS
Data scaling software	STARANISO
Phasing software	PHASER
Refinement software	BUSTER (2.11.8)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	61.264	1.974
High resolution limit [Å]	1.828	1.828
Number of reflections	32915	1646
<I/σ(I)>	8.4	1.2
Completeness [%]	78.9	19.5
Redundancy	8.1	6.9
CC(1/2)	0.991	0.390

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		291	15% PEG3350, 200 mM magnesium acetate, 100 mM Tris (pH 8.5)