1E6G

A-SPECTRIN SH3 DOMAIN A11V, V23L, M25I, V53I, V58L MUTANT

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	MACSCIENCE M18X
Temperature [K]	100
Collection date	2000-04-15
Detector	SMALL MARRESEARCH IMAGING PLATE
Spacegroup name	P 21 21 21
Unit cell lengths	29.190, 43.520, 53.320
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	8.000 - 2.300
R-factor	0.267
Rwork	0.267
R-free	0.27100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1shg
RMSD bond length	0.010
RMSD bond angle	27.730 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	X-PLOR (3.8)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	12.000	2.340
High resolution limit [Å]	2.300	2.260
Rmerge	0.100
Number of reflections	2863
Completeness [%]	87.3	79.1
Redundancy	2.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	unknown *	6	20 *	PROTEIN WAS CRYSTALLIZED FROM 1.1 M AMMONIUM SULPHATE, 90MM SODIUM CITRATE/CITRIC ACID, PH=6.0, 90 MM BIS-TRIS PROPANE, 0.9 MM EDTA, 0.9 MM DTT, 0.9 MM SODIUM AZIDE, pH 6.00

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	PEG4000
2	1	1	ammonium sulfate