1C9P

COMPLEX OF BDELLASTASIN WITH PORCINE TRYPSIN

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	277
Detector technology	IMAGE PLATE
Collection date	1998-05-13
Detector	MARRESEARCH
Spacegroup name	P 43 21 2
Unit cell lengths	63.330, 63.330, 130.610
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	8.000 - 2.800
R-factor	0.185 *
Rwork	0.185
R-free	0.22700
RMSD bond length	0.006
RMSD bond angle	25.040 *
Data reduction software	MOSFLM
Data scaling software	CCP4 ((AGROVATA)
Phasing software	AMoRE
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	10.000	2.900
High resolution limit [Å]	2.800	2.800
Rmerge	0.096	0.280
Total number of observations	31627 *
Number of reflections	7063 *
<I/σ(I)>	6.1
Completeness [%]	99.7	99.9
Redundancy	5.9 *	4.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5 *	21 *	0.1M HEPES, 10% 2-PROPANOL, 20% PEG 4000, pH 7.5, 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		150 (mM)
3	1	drop	MES	20 (mM)
4	1	reservoir	2-propanol	10 (%(v/v))
5	1	reservoir	PEG4000	20 (%(w/v))
6	1	reservoir	HEPPS	100 (mM)