4O3F

Crystal Structure of mouse PGK1 3PG and terazosin(TZN) ternary complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-17A
Synchrotron site	Photon Factory
Beamline	BL-17A
Temperature [K]	100
Detector technology	CCD
Collection date	2013-06-08
Detector	ADSC QUANTUM 4r
Wavelength(s)	0.98
Spacegroup name	P 21 21 2
Unit cell lengths	59.152, 71.397, 92.256
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.796 - 2.106
R-factor	0.185
Rwork	0.182
R-free	0.21320
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3c39
RMSD bond length	0.015
RMSD bond angle	1.281
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	CCP4
Refinement software	PHENIX (1.8.2_1309)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	2.370	2.140
High resolution limit [Å]	2.100	2.310	2.100
Number of reflections	23106
Completeness [%]	91.5	100	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	291	25-30% PEG 4000,0.1 M Tris-HCl pH 8.0, 0.2 M sodium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 291K