4XBO

Crystal structure of full length E.coli TrmJ in complex with SAH

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	2014-05-05
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.979
Spacegroup name	C 2 2 21
Unit cell lengths	113.863, 136.571, 99.612
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.912 - 2.600
R-factor	0.1975
Rwork	0.195
R-free	0.24230
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ilk
RMSD bond length	0.009
RMSD bond angle	1.203
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.9_1692))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.690
High resolution limit [Å]	2.600	2.600
Number of reflections	24427
<I/σ(I)>	19.4
Completeness [%]	99.9	100
Redundancy	7.2	6.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	Nacl, HEPES