1NRV

Crystal structure of the SH2 domain of Grb10

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X12C
Synchrotron site	NSLS
Beamline	X12C
Temperature [K]	110
Detector technology	CCD
Collection date	2001-05-09
Detector	CUSTOM-MADE
Wavelength(s)	0.9790
Spacegroup name	P 1 21 1
Unit cell lengths	28.820, 49.040, 79.610
Unit cell angles	90.00, 96.62, 90.00

Refinement procedure

Resolution	30.900 * - 1.650
R-factor	0.224
Rwork	0.224
R-free	0.24000 *
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1a81
RMSD bond length	0.005
RMSD bond angle	23.700 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.690
High resolution limit [Å]	1.650	1.650
Rmerge	0.045	0.370
Total number of observations	74325 *
Number of reflections	26168
<I/σ(I)>	10.5
Completeness [%]	99.6	99.2
Redundancy	2.84

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	4 *	12% PEG 8000, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	4 (mg/ml)
2	1	drop	HEPES	20 (mM)	pH7.5
3	1	drop		100 (mM)
4	1	reservoir	PEG8000	10 (%)
5	1	reservoir		100 (mM)	pH7.5
6	1	reservoir	TCEP	5 (mM)