8HRQ

Crystal structure of glyceraldehyde-3-phosphate dehydrogenase from Corynebacterium glutamicum ATCC13032 (L36S/T37K) in complex with NAD

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2021-10-31
Detector	ADSC QUANTUM 270
Wavelength(s)	0.98
Spacegroup name	C 1 2 1
Unit cell lengths	89.710, 117.891, 77.128
Unit cell angles	90.00, 116.92, 90.00

Refinement procedure

Resolution	26.710 - 2.090
R-factor	0.18023
Rwork	0.177
R-free	0.24550
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8hro
RMSD bond length	0.008
RMSD bond angle	1.591
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0403)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.140
High resolution limit [Å]	2.090	5.700	2.090
Rmerge	0.991	0.037	0.240
Number of reflections	39134	3795	3606
<I/σ(I)>	18.3
Completeness [%]	92.1	91.9	87.1
Redundancy	1.7	1.8	1.6
CC(1/2)	0.996

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	PEG 3350, Cesium chloride