6KVJ

Crystal structure of UDPX-SrUGT76G1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-11-02
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9798
Spacegroup name	P 31 2 1
Unit cell lengths	98.244, 98.244, 90.367
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	49.122 - 2.499
R-factor	0.1834
Rwork	0.181
R-free	0.22950
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2vce
RMSD bond length	0.011
RMSD bond angle	1.787
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX (1.10_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.122	2.589
High resolution limit [Å]	2.499	2.499
Rmeas	0.134
Number of reflections	24046	1378
<I/σ(I)>	16.5
Completeness [%]	100.0
Redundancy	8
CC(1/2)	0.998	0.716

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	20% (vol/vol) 2-propanol, 0.1M sodium citrate tribasic dihydrate, pH 5.9, 20% (wt/vol) pEG4000