1XZL

FUSARIUM SOLANI CUTINASE COMPLEX WITH N-HEXYLPHOSPHONATE ETHYL ESTER

Experimental procedure

Detector technology	IMAGE PLATE
Detector	MAR scanner 180 mm plate
Spacegroup name	P 1 21 1
Unit cell lengths	35.120, 67.360, 37.050
Unit cell angles	90.00, 93.90, 90.00

Refinement procedure

Resolution	6.000 - 1.690
R-factor	0.141
Rwork	0.141
RMSD bond length	0.008
RMSD bond angle	1.490
Data reduction software	XDS
Data scaling software	XDS
Phasing software	X-PLOR (3.1)
Refinement software	X-PLOR (3.1)

Data quality characteristics

	Overall
High resolution limit [Å]	1.690 *
Rmerge	0.026
Total number of observations	59064 *
Number of reflections	17053
Completeness [%]	88.0
Redundancy	3.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	PEG6000	2-20 (%(w/v))
2	1	drop	HEPES	100 (mM)
3	1	drop	cutinase	5-15 (mg/ml)
4	1	drop	n-octyl-beta-D-glucopyranoside	6 (mM)