1KF0

Crystal Structure of Pig Muscle Phosphoglycerate Kinase Ternary Complex with AMP-PCP and 3PG

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	297
Detector technology	IMAGE PLATE
Collection date	1996-04-03
Detector	MARRESEARCH
Wavelength(s)	1.5418
Spacegroup name	P 1 21 1
Unit cell lengths	36.600, 110.300, 48.000
Unit cell angles	90.00, 93.90, 90.00

Refinement procedure

Resolution	20.000 - 2.500
R-factor	0.2
Rwork	0.173
R-free	0.25240
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	pig muscle PGK ternary complex with MnAMP-PNP and 3-PG May et al. Proteins 24:292-303 1996)
RMSD bond length	0.004
RMSD bond angle	27.050 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	X-PLOR (3.851)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.600
High resolution limit [Å]	2.500	2.500
Rmerge	0.081	0.252
Number of reflections	12274
Completeness [%]	90.9 *	63.18 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	15 *	magnesium chloride, PEG 8000, PH 7.0, 288K, VAPOR DIFFUSION, HANGING DROP

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	AMP-PCP	10 (mM)
2	1	reservoir		12 (mM)
3	1	reservoir	3PG	10 (mM)
4	1	reservoir	PEG8000	27-28 (%(w/w))	pH7.0