5Y0S

Crystal structure of apo Thermotoga maritima TmcAL(Form II)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-17A
Synchrotron site	Photon Factory
Beamline	BL-17A
Temperature [K]	95
Detector technology	PIXEL
Collection date	2014-12-25
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.98
Spacegroup name	P 1 21 1
Unit cell lengths	80.990, 97.954, 144.279
Unit cell angles	90.00, 99.18, 90.00

Refinement procedure

Resolution	49.889 - 2.103
R-factor	0.1707
Rwork	0.169
R-free	0.20740
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5y0r
RMSD bond length	0.008
RMSD bond angle	1.055
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.8.4_1496)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000		2.160
High resolution limit [Å]	2.100	9.410	2.100
Rmerge	0.130	0.027	1.225
Rmeas	0.141	0.030	1.328
Number of reflections	128895	1517	9229
<I/σ(I)>	12.09	48.29	1.61
Completeness [%]	99.7	98.8	96.9
Redundancy	6.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	Tris, PEG8000, NaCl