6ZPZ

Structure of a-l-AraCS-Bound MgGH51 a-L-Arabinofuranosidase Crystal Type 1

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-12-15
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9119
Spacegroup name	P 21 21 21
Unit cell lengths	191.630, 58.090, 65.710
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	55.654 - 1.710
Rwork	0.187
R-free	0.22450
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6zps
RMSD bond length	0.012
RMSD bond angle	1.746
Data reduction software	xia2
Data scaling software	xia2
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	58.120	1.740
High resolution limit [Å]	1.710	1.710
Rpim	0.052	0.694
Number of reflections	79871	3871
<I/σ(I)>	8.7
Completeness [%]	98.8	98.5
Redundancy	7.5	6.7
CC(1/2)	0.997	0.419

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293	10 mg/mL MgGH51 in 10 mM NaOAc, pH 5.5, 100 mM NaCl mixed 2:1 with 20% PEG 3350, 0.1 M Bis-Tris-HCl, pH 6.5, 0.2 M NaNO3