7WVH

Structure of NAD+ glycohydrolase/Streptolysin O complex from Group A streptococcus

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL13B1
Synchrotron site	NSRRC
Beamline	BL13B1
Temperature [K]	100
Detector technology	CCD
Collection date	2020-06-11
Detector	ADSC QUANTUM 210
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	246.094, 52.477, 169.397
Unit cell angles	90.00, 132.04, 90.00

Refinement procedure

Resolution	26.120 - 2.450
R-factor	0.2158
Rwork	0.213
R-free	0.26450
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4kt6 4hsc
RMSD bond length	0.010
RMSD bond angle	1.204
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.490
High resolution limit [Å]	2.450	2.450
Rmerge	0.041
Rmeas	0.048
Rpim	0.025
Number of reflections	55058	985
<I/σ(I)>	17.3
Completeness [%]	96.4
Redundancy	3.6
CC(1/2)		0.874

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.3	295.15	17.5% PEG 3350, 100mM HEPES