4YYS

Ficin B crystal form II

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	CCD
Collection date	2013-03-12
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9801
Spacegroup name	P 1 21 1
Unit cell lengths	35.055, 66.961, 91.266
Unit cell angles	90.00, 97.00, 90.00

Refinement procedure

Resolution	34.793 - 1.350
R-factor	0.1587
Rwork	0.158
R-free	0.17350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4yyr
RMSD bond length	0.010
RMSD bond angle	1.230
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.6.1_357))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	34.793	1.390
High resolution limit [Å]	1.350	1.350
Number of reflections	91483
<I/σ(I)>	10.6
Completeness [%]	99.8	85
Redundancy	3.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	20% (w/v) PEG4000, 0.1 M Na Hepes 7.5, 10% (v/v) isopropanol