4HJX

Crystal structure of F2YRS complexed with F2Y

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	CCD
Collection date	2012-08-23
Detector	Rigaku Satun 944 HG
Wavelength(s)	1.5418
Spacegroup name	P 43
Unit cell lengths	101.307, 101.307, 71.779
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.594 - 2.910
R-factor	0.2135
Rwork	0.211
R-free	0.26760
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1j1u
RMSD bond length	0.002
RMSD bond angle	0.567
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP (- auto MR)
Refinement software	PHENIX ((phenix.refine: 1.8_1069))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.010
High resolution limit [Å]	2.910	2.910
Rmerge	0.105	0.448
Number of reflections	16105
<I/σ(I)>	17.5	3.3
Completeness [%]	99.7	99.8
Redundancy	6.8	6.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1