7EBQ

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	2020-07-08
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97930
Spacegroup name	C 2 2 21
Unit cell lengths	64.170, 113.469, 164.579
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.440 - 2.400
R-factor	0.2086
Rwork	0.205
R-free	0.24310
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5g2v
RMSD bond length	0.009
RMSD bond angle	1.103
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.440	2.370
High resolution limit [Å]	2.300	2.300
Rmeas	0.222	0.834
Number of reflections	30831	3030
<I/σ(I)>	5.16
Completeness [%]	99.7
Redundancy	8.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		292	0.08M Sodium HEPES, 23% w/v PEG 8000, pH7.3