5V8X

Mutant Structures of Streptococcus Agalactiae GBS Glyceraldehyde-3-Phosphate Dehydrogenase (GAPDH)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-11-12
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9791
Spacegroup name	P 1 21 1
Unit cell lengths	68.104, 107.805, 91.432
Unit cell angles	90.00, 105.73, 90.00

Refinement procedure

Resolution	46.800 - 2.950
R-factor	0.2242
Rwork	0.222
R-free	0.27030
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5jy6
RMSD bond length	0.008
RMSD bond angle	1.307
Data reduction software	XDS (Oct. 2015)
Data scaling software	SCALA (0.5.17)
Phasing software	PHASER (2.7.17)
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	107.800	3.130
High resolution limit [Å]	2.950	2.950
Rmerge	0.125	1.560
Rmeas	0.141	1.742
Rpim	0.063	0.764
Number of reflections	26679
<I/σ(I)>	9.5
Completeness [%]	99.3	99.8
Redundancy	4.8	4.9
CC(1/2)	0.996	0.527

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	295	20-27% PEG 4000, 0.1 M Mes pH 6.5