7DSZ

Crystal structure of Amuc_1102 from Akkermansia muciniphila

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-06-29
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9793
Spacegroup name	P 21 21 21
Unit cell lengths	83.469, 83.941, 107.252
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	25.644 - 1.750
R-factor	0.1733
Rwork	0.172
R-free	0.19990
Structure solution method	SAD
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	SHELXDE
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.810
High resolution limit [Å]	1.750	3.770	1.750
Rmerge	0.074	0.030	0.822
Rmeas	0.080	0.033	0.896
Rpim	0.029	0.012	0.351
Total number of observations	555345
Number of reflections	76720	8048	7572
<I/σ(I)>	5.6
Completeness [%]	100.0	100	100
Redundancy	7.2	7	6.3
CC(1/2)		0.999	0.686

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	0.1 M Sodium acetate, pH 4.6, and 2 M NaCl