2FPF

Crystal structure of the ib1 sh3 dimer at low resolution

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	CCD
Collection date	2003-02-22
Detector	ADSC QUANTUM 210
Spacegroup name	P 21 21 21
Unit cell lengths	45.868, 57.000, 145.497
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.770 - 3.000
R-factor	0.224
Rwork	0.224
R-free	0.25100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2fpd
RMSD bond length	0.007
RMSD bond angle	1.400
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	3.110
High resolution limit [Å]	3.000	3.000
Rmerge	0.102	0.461
Number of reflections	8075
<I/σ(I)>	12.07	2.9
Completeness [%]	99.2	100
Redundancy	4.6	4.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	SODIUM CITRATE, HEPES, HYDROGEN PEROXIDE, pH 6.50, VAPOR DIFFUSION, HANGING DROP, temperature 293K