5ZIA

Crystal structure of human anti-tau antibody CBTAU-24.1 in complex with its phosphorylated tau peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-04-12
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9795
Spacegroup name	P 1
Unit cell lengths	86.353, 107.811, 107.931
Unit cell angles	62.16, 71.02, 90.77

Refinement procedure

Resolution	46.864 - 2.603
R-factor	0.2021
Rwork	0.200
R-free	0.24880
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4q9q
RMSD bond length	0.013
RMSD bond angle	1.131
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.640
High resolution limit [Å]	2.600	2.600
Rmerge	0.125	0.526
Rmeas	0.182	0.637
Rpim	0.094	0.351
Number of reflections	88890	3914
<I/σ(I)>	8.3	1.7
Completeness [%]	91.1	79.3
Redundancy	3.4	2.6
CC(1/2)	0.900	0.650

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	293	50% (v/v) MPD, 0.2M (NH4)H2PO4, 0.1M Tris pH8.5