3OZ6

Crystal structure of MapK from Cryptosporidium Parvum, cgd2_1960

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2010-07-21
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97924
Spacegroup name	P 21 21 21
Unit cell lengths	74.298, 91.746, 119.985
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.680 - 2.370
R-factor	0.2321
Rwork	0.231
R-free	0.25970
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.100
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER (2.1.4)
Refinement software	BUSTER-TNT

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.390
High resolution limit [Å]	2.350	6.370	2.350
Rmerge	0.115	0.037	0.889
Number of reflections	33480
<I/σ(I)>	5.5		1.6
Completeness [%]	99.9	99.4	99.2
Redundancy	7	6.5	6.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	20% PEG 3350 0.1 M MgAcetate 4 mM AMPPNP 4 mM MGCl2 4 mM TCEP, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K