7EBP

The structural analysis of A.Muciniphila sulfatase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	CCD
Collection date	2020-03-12
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97930
Spacegroup name	P 21 21 21
Unit cell lengths	64.342, 112.722, 165.011
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.289 - 1.800
R-factor	0.187402578451
Rwork	0.186
R-free	0.20891
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5g2v
RMSD bond length	0.014
RMSD bond angle	1.517
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692+SVN)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.360	1.850
High resolution limit [Å]	1.770	1.800
Rmeas	0.104	0.268
Number of reflections	117585	7847
<I/σ(I)>	39.1
Completeness [%]	98.4
Redundancy	10

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		292	0.11M Sodium HEPES, 18% w/v PEG 8000, pH6.5