7SZB

Crystal Structure Analysis of human PRPK complex with a compound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-02-16
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9792
Spacegroup name	C 1 2 1
Unit cell lengths	295.770, 47.630, 62.140
Unit cell angles	90.00, 96.77, 90.00

Refinement procedure

Resolution	61.707 - 2.020
R-factor	0.1718
Rwork	0.170
R-free	0.20900
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3enp 4ww5
RMSD bond length	0.014
RMSD bond angle	1.328
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	61.710	61.740	2.050
High resolution limit [Å]	2.020	5.480	2.020
Rmeas	0.091	0.028	1.094
Rpim	0.047	0.015	0.562
Total number of observations	208593	10313	10568
Number of reflections	56764	2960	2841
<I/σ(I)>	14.3	40.5	1.6
Completeness [%]	99.6	98.4	100
Redundancy	3.7	3.5	3.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.2	293	100mM Sodium citrate pH 5.2, 12.8% PEG8000, 10mM MgCl2, 10mM TCEP