4TLI

THERMOLYSIN (25% ISOPROPANOL SOAKED CRYSTALS)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	293
Detector technology	IMAGE PLATE
Collection date	1997-06-01
Detector	MAR scanner 300 mm plate
Spacegroup name	P 61 2 2
Unit cell lengths	94.140, 94.140, 130.800
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.000 - 1.950
Rwork	0.164
R-free	0.20600
Structure solution method	ISOMORPHOUS REPLACEMENT
RMSD bond length	0.014
RMSD bond angle	0.032
Data reduction software	DENZO
Data scaling software	CCP4
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.080
High resolution limit [Å]	1.950	1.950
Rmerge	0.093	0.372
Number of reflections	24598
<I/σ(I)>	5.9	2
Completeness [%]	97.0	95
Redundancy	6.5	6.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7.5		4.6MM THERMOLYSIN, 45% DMSO, 50MM TRIS-HCL, 2.5M CSCL, PH 7.5, pH 7.50