4J4W

Crystal structure of BueVN

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2011-11-26
Detector	ADSC QUANTUM 315
Wavelength(s)	0.98
Spacegroup name	I 4 2 2
Unit cell lengths	97.106, 97.106, 176.644
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.669 - 2.661
R-factor	0.2136
Rwork	0.211
R-free	0.25400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4j4r
RMSD bond length	0.009
RMSD bond angle	1.047
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASES
Refinement software	PHENIX ((phenix.refine: 1.8_1069))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	32.670	2.760
High resolution limit [Å]	2.660	2.660
Number of reflections	12518
Completeness [%]	99.5	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1