7PKC

Streptococcus pyogenes Apo-GapN C284S variant

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-04-09
Detector	DECTRIS PILATUS3 X 2M
Wavelength(s)	0.873128
Spacegroup name	P 1
Unit cell lengths	97.665, 126.036, 148.393
Unit cell angles	96.36, 104.81, 84.23

Refinement procedure

Resolution	19.970 - 1.500
R-factor	0.2007
Rwork	0.200
R-free	0.23160
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	unpublished
RMSD bond length	0.008
RMSD bond angle	1.010
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	BUSTER (2.10.4)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.634	1.635
High resolution limit [Å]	1.499	1.499
Rmerge	0.122	0.705
Rmeas	0.151	0.866
Rpim	0.087	0.497
Number of reflections	744804	37234
<I/σ(I)>	5.444	1.569
Completeness [%]	90.0	63.75
Redundancy	2.76	2.89
CC(1/2)	0.992	0.466

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293.15	0.2 M lithium sulfate 0.1 M Bis-Tris pH 6.5 18 % PEG 3350