5TEX

Pim-1 kinase in complex with a 7-azaindole

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	93
Detector technology	CCD
Collection date	2005-06-20
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.979
Spacegroup name	P 65
Unit cell lengths	97.536, 97.536, 81.104
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	37.460 - 2.149
R-factor	0.1842
Rwork	0.181
R-free	0.21670
RMSD bond length	0.009
RMSD bond angle	1.003
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX ((1.10_2155: ???))

Data quality characteristics

	Overall
Low resolution limit [Å]	37.460
High resolution limit [Å]	2.149
Number of reflections	23887
<I/σ(I)>	3.67
Completeness [%]	99.5
Redundancy	13.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	6.5	277	imidazole 0,1M - NaAcetate 1M - pH6,5