8IYF

Structure of VldE-H182A in complex with GDP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE TPS 05A
Synchrotron site	NSRRC
Beamline	TPS 05A
Temperature [K]	100
Detector technology	CCD
Collection date	2017-08-23
Detector	RAYONIX MX300-HS
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	48.009, 121.263, 84.544
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.010 - 1.900
R-factor	0.1965
Rwork	0.195
R-free	0.24110
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.972
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.010	1.940
High resolution limit [Å]	1.900	1.900
Rmerge	0.090	0.518
Number of reflections	74391	4500
<I/σ(I)>	10.3	2.3
Completeness [%]	97.9
Redundancy	4.4
CC(1/2)	0.992	0.805

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	100 mM Tris-HCl, pH8.5, 26% PEG 4000