7BSR

Mandelate oxidase with the 2-Hydroxy-3-oxosuccinic acid

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL15A1
Synchrotron site	NSRRC
Beamline	BL15A1
Temperature [K]	100
Detector technology	CCD
Collection date	2018-04-19
Detector	RAYONIX MX300HE
Wavelength(s)	1
Spacegroup name	I 4 2 2
Unit cell lengths	138.440, 138.440, 109.144
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.228 - 1.894
R-factor	0.2221
Rwork	0.220
R-free	0.25690
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3sgz
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.7)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.970
High resolution limit [Å]	1.890	1.894
Rmerge	0.039	0.745
Number of reflections	41750	4154
<I/σ(I)>	36.4	2.6
Completeness [%]	98.9
Redundancy	9.7
CC(1/2)		0.837

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	35% Tascimate, 0.1M Bis-Tris propane pH 7.0