6WT3

Structural basis for the binding of monoclonal antibody 5D2 to the tryptophan-rich lipid-binding loop in lipoprotein lipase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-01-21
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9686
Spacegroup name	C 1 2 1
Unit cell lengths	138.790, 37.070, 107.960
Unit cell angles	90.00, 126.19, 90.00

Refinement procedure

Resolution	43.570 - 2.850
R-factor	0.256
Rwork	0.253
R-free	0.30760
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6wn4
RMSD bond length	0.003
RMSD bond angle	0.689
Data reduction software	XDS (20200131)
Data scaling software	STARANISO (2.3.28)
Phasing software	PHASER (2.8.3)
Refinement software	PHENIX ((1.18_3855: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.570	2.910
High resolution limit [Å]	2.848	2.848
Rmerge	0.164	0.515
Rpim	0.116	0.407
Number of reflections	10111	525
<I/σ(I)>	4.9	1.6
Completeness [%]	97.7	80.3
Redundancy	2.8	2.1
CC(1/2)	0.976	0.617

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	100mM 2-(N-morpholino)ethanesulfonic acid, 150mM ammonium sulfate, 24% PEG 4000