5TNW

Phospholipase C gamma-1 C-terminal SH2 domain

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	2016-05-04
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.000
Spacegroup name	P 1
Unit cell lengths	33.360, 36.650, 38.780
Unit cell angles	90.20, 101.89, 97.20

Refinement procedure

Resolution	37.931 - 1.400
R-factor	0.1884
Rwork	0.187
R-free	0.21500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4k44
RMSD bond length	0.004
RMSD bond angle	0.722
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.22)
Phasing software	PHASER (2.5.7)
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	37.931	37.931	1.440
High resolution limit [Å]	1.366	4.320	1.370
Rmerge		0.049	0.272
Rmeas	0.105
Rpim	0.069
Total number of observations	68865
Number of reflections	34467
<I/σ(I)>	5.7	11.5	2.4
Completeness [%]	91.2	88.1	84.1
Redundancy	2	2	1.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	0.1 M Imidazole (pH 7.0), 20% Jeffamine ED-2001 (pH 7.0)