9O1Y

Heparanase P6 in complex with fragment J29

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-08-11
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9537
Spacegroup name	P 21 21 21
Unit cell lengths	58.657, 74.646, 125.058
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.930 - 2.000
R-factor	0.2037
Rwork	0.202
R-free	0.23630
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.911
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.930	2.050
High resolution limit [Å]	2.000	2.000
Rmerge	1.551
Rmeas	1.617	64.585
Rpim	0.451	19.235
Total number of observations	487393
Number of reflections	37931	2764
<I/σ(I)>	5.1
Completeness [%]	100.0
Redundancy	12.8	11.4
CC(1/2)	0.861	0.643

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	0.2 M Ammonium sulfate, 0.1 M ammoniuma acetate, 25% PEG 4000