1MXS

Crystal structure of 2-keto-3-deoxy-6-phosphogluconate (KDPG) aldolase from Pseudomonas putida.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	296
Detector technology	IMAGE PLATE
Detector	RIGAKU RAXIS II
Wavelength(s)	1.54
Spacegroup name	P 21 3
Unit cell lengths	103.300, 103.300, 103.300
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	9999.000 * - 2.200
R-factor	0.171
Rwork	0.171
R-free	0.21400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1eun
RMSD bond length	0.006
RMSD bond angle	22.400 *
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	9.980	50.000
High resolution limit [Å]	2.200	2.200
Rmerge	0.046 *
Total number of observations	66178 *
Number of reflections	9901
Completeness [%]	52.3 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICRODIALYSIS	3.5	296	ammonium sulfate, KH2PO4, pH 3.5, MICRODIALYSIS, temperature 296K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	protein	15 (mg/ml)
2	1	2	ammonium sulfate	1.5 (M)
3	1	2		0.1 (M)	pH3.5