7QYJ

The structure of T. forsythia NanH

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-28
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97795
Spacegroup name	P 41 21 2
Unit cell lengths	80.055, 80.055, 349.751
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	66.082 - 2.110
Rwork	0.240
R-free	0.26610
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4bbw
RMSD bond length	0.006
RMSD bond angle	1.434
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	66.082	2.150
High resolution limit [Å]	2.110	2.110
Rmerge	0.125	2.359
Number of reflections	67026	3225
<I/σ(I)>	11.4	1
Completeness [%]	100.0
Redundancy	12.8
CC(1/2)	0.895	0.610

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	300	7% PEG6000 0.1M HEPES