5FH0

The structure of rat cytosolic PEPCK variant E89A complex with GTP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	CCD
Collection date	2014-07-04
Detector	RAYONIX MX-300
Wavelength(s)	0.97949
Spacegroup name	P 21 21 21
Unit cell lengths	60.428, 85.710, 118.415
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	69.430 - 1.600
R-factor	0.2023
Rwork	0.201
R-free	0.23160
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3dt2
RMSD bond length	0.010
RMSD bond angle	1.480
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	100.000	100.000	1.660
High resolution limit [Å]	1.600	3.450	1.600
Rmerge	0.066	0.047	0.344
Rmeas	0.068	0.049	0.361
Rpim	0.018	0.013	0.107
Total number of observations	1129880
Number of reflections	81130
<I/σ(I)>	16.8
Completeness [%]	99.2	98.6	92.9
Redundancy	13.9	14.1	10.8
CC(1/2)		0.999	0.970

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.4	298	25% PEG 3350, 0.1M HEPES PH 7.4, 8MM MNCL2, 10mM GTP