6DF2

Improved anti-phosphotyrosine antibody 4G10-S5-4D5 Fab complexed with phosphotyrosine peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.3.1
Synchrotron site	ALS
Beamline	8.3.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-04-08
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	136.510, 110.550, 69.080
Unit cell angles	90.00, 110.38, 90.00

Refinement procedure

Resolution	83.656 - 2.600
R-factor	0.1793
Rwork	0.177
R-free	0.23030
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1bj1
RMSD bond length	0.004
RMSD bond angle	0.767
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	84.000	2.693
High resolution limit [Å]	2.600	2.600
Rmerge	0.210	1.258
Number of reflections	29644	2940
<I/σ(I)>	13.2
Completeness [%]	100.0	100
Redundancy	13.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	298	26% PEG3350, 0.1M Bis-Tris, and 0.16M ammonium acetate