4QSY

SHP2 SH2 domain in complex with GAB1 peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2012-05-17
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	P 43 21 2
Unit cell lengths	61.780, 61.780, 74.190
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.685 - 2.100
R-factor	0.2014
Rwork	0.200
R-free	0.22910
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ayd
RMSD bond length	0.004
RMSD bond angle	0.829
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.4_1496))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.690	2.150
High resolution limit [Å]	2.100	2.100
Number of reflections	8862	623
<I/σ(I)>		2.77
Completeness [%]	99.6	98.3
Redundancy		2.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	295	25% PEG3000, 0.1M MES, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 295.0K