5TQS

Phospholipase C gamma-1 C-terminal SH2 domain bound to a phosphopeptide derived from the receptor tyrosine kinase ErbB2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-08-04
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.000
Spacegroup name	P 1 21 1
Unit cell lengths	65.320, 30.620, 104.570
Unit cell angles	90.00, 100.12, 90.00

Refinement procedure

Resolution	51.472 - 1.876
R-factor	0.1909
Rwork	0.189
R-free	0.23700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4k44
RMSD bond length	0.007
RMSD bond angle	0.820
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.22)
Phasing software	PHASER (2.6.1)
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	64.304	64.304	1.980
High resolution limit [Å]	1.876	5.930	1.876
Rmerge		0.057	0.433
Rmeas	0.102
Rpim	0.055
Total number of observations	112903
Number of reflections	33698
<I/σ(I)>	9.1	8.6	1.5
Completeness [%]	99.0	99	96.3
Redundancy	3.4	3.2	2.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	0.1 M sodium acetate (pH 5.5), 22% PEG MME 5000