1SBW

CRYSTAL STRUCTURE OF MUNG BEAN INHIBITOR LYSINE ACTIVE FRAGMENT COMPLEX WITH BOVINE BETA-TRYPSIN AT 1.8A RESOLUTION

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Temperature [K]	293
Detector technology	IMAGE PLATE
Collection date	1997-10-01
Detector	RIGAKU
Spacegroup name	P 21 21 21
Unit cell lengths	63.270, 63.550, 69.440
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	70.000 - 1.800
Rwork	0.164
R-free	0.19600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1tld
RMSD bond length	0.006
RMSD bond angle	1.450
Refinement software	X-PLOR (3.8)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	70.000	1.880
High resolution limit [Å]	1.800	1.800
Rmerge	0.043	0.038
Number of reflections	23601
<I/σ(I)>	12
Completeness [%]	88.8	70.7
Redundancy	3	2.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		6		pH 6.0