6MZP

Zebrafish betaglycan orphan domain structure from orthorhombic crystal form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2017-10-04
Detector	RAYONIX MX300-HS
Wavelength(s)	0.9692
Spacegroup name	P 21 21 21
Unit cell lengths	63.520, 107.270, 113.240
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.980 - 2.100
R-factor	0.233
Rwork	0.232
R-free	0.25800
Structure solution method	MIRAS
RMSD bond length	0.010
RMSD bond angle	1.170
Data reduction software	MOSFLM (7.2.2)
Data scaling software	SCALA
Phasing software	SHARP
Refinement software	BUSTER (2.10.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.980	2.160
High resolution limit [Å]	2.100	2.100
Rmerge	0.126	2.493
Rmeas	0.137	2.719
Rpim	0.053	1.069
Number of reflections	45850	3715
<I/σ(I)>	14	1.3
Completeness [%]	99.9	99.6
Redundancy	11.6	11.2
CC(1/2)	0.998	0.565

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	9.2% v/v PEG 5K mono methyl ether, 4.6% w/v PEG 20K, 0.1M MES pH 6.2