4Q9V

Crystal structure of TIPE3

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	2012-10-06
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9796
Spacegroup name	I 2 2 2
Unit cell lengths	61.729, 87.296, 242.309
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.744 - 2.300
R-factor	0.2409
Rwork	0.240
R-free	0.26190
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3f4m
RMSD bond length	0.009
RMSD bond angle	1.137
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.7.3_928))

Data quality characteristics

	Overall
Low resolution limit [Å]	40.000
High resolution limit [Å]	2.300
Number of reflections	29415
Completeness [%]	99.0

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.7	291	0.1M MES6.7,1.95M (NH4)2SO4, VAPOR DIFFUSION, HANGING DROP, temperature 291K