1C9T

COMPLEX OF BDELLASTASIN WITH BOVINE TRYPSIN

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	277
Detector technology	IMAGE PLATE
Collection date	1997-04-17
Detector	MARRESEARCH
Spacegroup name	P 1 21 1
Unit cell lengths	95.220, 108.780, 95.710
Unit cell angles	90.00, 93.70, 90.00

Refinement procedure

Resolution	8.000 - 3.300
R-factor	0.208
Rwork	0.208
R-free	0.28700
RMSD bond length	0.010 *
RMSD bond angle	1.561 *
Data reduction software	MOSFLM
Data scaling software	CCP4 ((AGROVATA)
Phasing software	AMoRE
Refinement software	X-PLOR (3.851)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.000	3.420
High resolution limit [Å]	3.300	3.300
Rmerge	0.110	0.290
Number of reflections	23797 *
<I/σ(I)>	4.3
Completeness [%]	81.2	77
Redundancy	2.2	1.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5 *	21 *	50MM MES, 2.0M AMMONIUM SULFATE, 10MM MAGNESIM CHLORIDE, pH 5.6, VAPOR DIFFUSION, SITTING DROP, temperature 293K
1	VAPOR DIFFUSION, SITTING DROP	6.5 *	21 *	50MM MES, 2.0M AMMONIUM SULFATE, 10MM MAGNESIM CHLORIDE, pH 5.6, VAPOR DIFFUSION, SITTING DROP, temperature 293K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	10 (mg/ml)
2	1	drop	sodium chloride	150 (mM)
3	1	reservoir	ammonium sulfate	2.2 (M)
4	1	reservoir	magnesium chloride	10 (mM)
5	1	reservoir	MES	50 (mM)