3ADP

Crystal Structure of the Rabbit L-Gulonate 3-Dehydrogenase (NADH Form)

Replaces:  3A97Replaces:  2EP9

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2005-12-22
Detector	RIGAKU RAXIS VII
Wavelength(s)	1.5418
Spacegroup name	C 1 2 1
Unit cell lengths	72.016, 69.517, 65.096
Unit cell angles	90.00, 102.70, 90.00

Refinement procedure

Resolution	23.440 - 1.850
R-factor	0.168
Rwork	0.166
R-free	0.20000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2DPO
RMSD bond length	0.006
RMSD bond angle	1.200
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.920
High resolution limit [Å]	1.850	1.850
Rmerge	0.052	0.229
Number of reflections	26610
<I/σ(I)>	11.2	4.85
Completeness [%]	99.1	97.8
Redundancy	3.2	3.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH			MICROBATCH