1QH9

ENZYME-PRODUCT COMPLEX OF L-2-HALOACID DEHALOGENASE

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU300
Temperature [K]	293
Detector technology	IMAGE PLATE
Collection date	1998-01
Detector	RIGAKU
Spacegroup name	C 1 2 1
Unit cell lengths	91.810, 62.760, 51.380
Unit cell angles	90.00, 123.07, 90.00

Refinement procedure

Resolution	8.000 - 2.500
Rwork	0.194
R-free	0.28700
Structure solution method	OTHER
RMSD bond length	0.005
RMSD bond angle	1.200
Data reduction software	PROCESS
Data scaling software	PROCESS
Phasing software	X-PLOR
Refinement software	X-PLOR (3.851)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.630	2.800
High resolution limit [Å]	2.500	2.500
Rmerge	0.080
Number of reflections	8320
<I/σ(I)>	9.3
Completeness [%]	95.2	93.1
Redundancy	3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		5.5		pH 5.5