5ZQV

Crystal Structure of Protein Phosphate 1 complexed with PP1 binding domain of GM

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-10-27
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9793
Spacegroup name	P 41
Unit cell lengths	111.973, 111.973, 195.299
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.288 - 2.950
R-factor	0.2537
Rwork	0.252
R-free	0.29670
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4mp0
RMSD bond length	0.002
RMSD bond angle	0.567
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	3.000
High resolution limit [Å]	2.950	8.000	2.950
Rmerge	0.099	0.075	1.336
Rpim	0.096
Number of reflections	50718	2411	2533
<I/σ(I)>	3.2
Completeness [%]	99.5	92.2	100
Redundancy	7.4	6.9	7.4
CC(1/2)		0.995	0.608

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	277	0.2M lithium citrate, 11% poly(ethylene glycol) 3350, 4.5% benzamidine hydrochloride hydrate