1M27

Crystal structure of SAP/FynSH3/SLAM ternary complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU300
Temperature [K]	160
Detector technology	IMAGE PLATE
Collection date	2001-10-20
Detector	MARRESEARCH
Wavelength(s)	1.54
Spacegroup name	P 41 21 2
Unit cell lengths	52.909, 52.909, 183.079
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 2.500
R-factor	0.213
Rwork	0.213
R-free	0.24600 *
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007 *
RMSD bond angle	1.250 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.590
High resolution limit [Å]	2.500	2.500
Rmerge	0.044 *	0.246 *
Total number of observations	29117 *
Number of reflections	9233 *
Completeness [%]	95.5 *	95.5 *
Redundancy	3.2 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion *	8 *	22 *	Tartrate, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 297K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	15 (mg/ml)
2	1	drop	Tris-HCl	20 (mM)	pH8.0
3	1	drop		50 (mM)
4	1	drop	dithiothreitol	5 (mM)
5	1	reservoir	sodium tartrate	1.2 (M)
6	1	reservoir	Tris-HCl	100 (mM)	pH8.0
7	1	reservoir	dithiothreitol	5 (mM)