8DEK

The structure of the glycopeptidase catalytic domain including the linker of Amuc_1438

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-002
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-03-20
Detector	DECTRIS PILATUS 200K
Wavelength(s)	1.54187
Spacegroup name	P 21 21 21
Unit cell lengths	71.233, 91.471, 161.674
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.920 - 2.500
R-factor	0.2342
Rwork	0.232
R-free	0.28310
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.449
Phasing software	SHARP
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.000	2.540
High resolution limit [Å]	2.500	2.500
Rpim	0.043	0.195
Number of reflections	36634	1773
<I/σ(I)>	15.2
Completeness [%]	98.7
Redundancy	4.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.2M (NH4)2PO4, 20% (W/V) peg3350, and 0,1M bicine, pH 9.0