9JCN

Crystal structure of Zea mays 3-phosphoglycerate dehydrogenase S282L mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL10U2
Synchrotron site	SSRF
Beamline	BL10U2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-06-09
Detector	DECTRIS EIGER2 S 9M
Wavelength(s)	0.97918
Spacegroup name	P 65 2 2
Unit cell lengths	96.345, 96.345, 503.003
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	22.970 - 3.480
R-factor	0.2119
Rwork	0.208
R-free	0.22810
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.013
RMSD bond angle	1.462
Data reduction software	DIALS
Data scaling software	DIALS
Phasing software	PHENIX
Refinement software	PHENIX ((1.20.1_4487: 000))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	83.830	7.770
High resolution limit [Å]	3.480	3.480
Number of reflections	18472	12545
<I/σ(I)>	9.4
Completeness [%]	96.6
Redundancy	22.13
CC(1/2)	0.996	1.000

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277.15	0.2M Sodium formate 0.2M Ammonium acetate 0.2M Sodium citrate tribasic dihydrate 0.2M Potassium sodium tartrate tetrahydrate 0.2M Sodium oxamate 1.0M Tris (base); BICINE pH8.5 40% v/v Ethylene glycol 20 % w/v PEG 8000