7OKR

Catalytic domain from the Aliivibrio salmonicida lytic polysaccharide monooxygenase AsLPMO10B

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	MAX IV BEAMLINE BioMAX
Synchrotron site	MAX IV
Beamline	BioMAX
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-12-05
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.976254
Spacegroup name	P 65
Unit cell lengths	71.003, 71.003, 100.203
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	33.460 - 1.350
Rwork	0.139
R-free	0.16240
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4yn2
RMSD bond length	0.016
RMSD bond angle	1.862
Data reduction software	XDS (VERSION Mar 15, 2019 BUILT=20190806)
Data scaling software	XSCALE (VERSION Mar 15, 2019 BUILT=20190806)
Phasing software	PHASER (2.8.3)
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.460	1.400
High resolution limit [Å]	1.350	1.350
Rpim	0.022	0.585
Number of reflections	62730	6133
<I/σ(I)>	15.3	0.9
Completeness [%]	99.9	99.7
Redundancy	18.2	9.7
CC(1/2)	0.999	0.545

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.2	293.15	0.1 M phosphate/citrate pH 4.2, 40 % PEG 300