3MVJ

Human cyclic AMP-dependent protein kinase PKA inhibitor complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E DW
Temperature [K]	100
Detector technology	IMAGE PLATE
Detector	RIGAKU RAXIS IV
Wavelength(s)	1.54
Spacegroup name	P 21 21 21
Unit cell lengths	61.163, 120.828, 162.415
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.750 - 2.490
R-factor	0.21671
Rwork	0.212
R-free	0.30436
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.018
RMSD bond angle	1.816
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	95.350	2.590
High resolution limit [Å]	2.490	2.490
Rmerge	0.158	0.683
Number of reflections	41833
<I/σ(I)>	6.9
Completeness [%]	98.0	96.9
Redundancy	7.1	6.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1