8A8Y

Structure of truncated 1-deoxy-D-xylulose 5-phosphate synthase (DXS) from Klebsiella pneumoniae

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-04-03
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97
Spacegroup name	C 2 2 21
Unit cell lengths	119.164, 144.247, 142.911
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.935 - 2.100
R-factor	0.18023954443
Rwork	0.179
R-free	0.20105
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2o1s
RMSD bond length	0.002
RMSD bond angle	0.527
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	91.900	2.210
High resolution limit [Å]	2.100	2.100
Rmerge	0.089	0.720
Number of reflections	71565	10344
<I/σ(I)>	9.9
Completeness [%]	99.6
Redundancy	4.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	PEG 8000, Magnesium chloride, TRIS