8HRR

Crystal structure of glyceraldehyde-3-phosphate dehydrogenase from Corynebacterium glutamicum ATCC13032 (L36S/T37K/F100V) in complex with NADP

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	89.691, 117.066, 75.727
Unit cell angles	90.00, 116.63, 90.00

Refinement procedure

Resolution	35.340 - 2.000
R-factor	0.18009
Rwork	0.178
R-free	0.22249
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8hro
RMSD bond length	0.007
RMSD bond angle	1.426
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	2.030
High resolution limit [Å]	2.000	5.430	2.000
Rmerge	0.984	0.056	0.257
Total number of observations	172666
Number of reflections	44734	4483	4205
<I/σ(I)>	15.2
Completeness [%]	95.7	95.7	91.3
Redundancy	1.9	2	1.8
CC(1/2)	0.991

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	PEG 3350, Sodium formate