6Q9R

Crystal structure of the pathological N184K variant of calcium-free human gelsolin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-04-16
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.07
Spacegroup name	P 4 21 2
Unit cell lengths	169.848, 169.848, 150.513
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	75.257 - 2.730
R-factor	0.215
Rwork	0.213
R-free	0.26010
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ffn
RMSD bond length	0.004
RMSD bond angle	0.708
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	75.260	2.800
High resolution limit [Å]	2.730	2.730
Rmeas	0.193
Number of reflections	58899	4493
<I/σ(I)>	8.3	2.1
Completeness [%]	99.9	100
Redundancy	9.1	9.4
CC(1/2)	0.996	0.353

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293	1.5 M ammonium sulfate, 15 % glycerol, 100 mM Tris-HCl