4JWG

Crystal structure of spTrm10(74)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2011-12-02
Detector	RAYONIX MX-225
Wavelength(s)	0.9792
Spacegroup name	C 2 2 21
Unit cell lengths	51.677, 69.568, 121.076
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.480 - 2.500
R-factor	0.2145
Rwork	0.211
R-free	0.28390
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4jwf
RMSD bond length	0.017
RMSD bond angle	1.727
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER (2.1.4)
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.590
High resolution limit [Å]	2.500	5.380	2.500
Rmerge	0.090	0.045	0.492
Number of reflections	7871
<I/σ(I)>	11.9
Completeness [%]	99.8	99.2	100
Redundancy	7	6.5	7.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5	287	15% PEG 6000, 0.1M Na acetate, pH 5.0, vapor diffusion, hanging drop, temperature 287K