7ZEU

Crystal structure of human Clusterin, crystal form II

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-12-02
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.77490
Spacegroup name	C 1 2 1
Unit cell lengths	194.440, 46.438, 155.173
Unit cell angles	90.00, 127.20, 90.00

Refinement procedure

Resolution	29.770 - 3.500
R-factor	0.2375
Rwork	0.235
R-free	0.28360
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7zet
Data reduction software	XDS (VERSION Feb 5, 2021)
Data scaling software	Aimless (0.7.4)
Phasing software	MOLREP (11.4.06)
Refinement software	PHENIX (1.19.2-4158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.590	48.590	3.830
High resolution limit [Å]	3.500	8.570	3.500
Rmerge	0.211	0.077	1.517
Rmeas	0.229	0.083	1.664
Rpim	0.085	0.031	0.672
Total number of observations	103733	7130	19449
Number of reflections	14413	1053	3408
<I/σ(I)>	6.1	19.3	1.4
Completeness [%]	99.8	99.4	99.6
Redundancy	7.2	6.8	5.7
CC(1/2)	0.995	0.995	0.619

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	277	24% PEG-1500, 20% glycerol