1S63

Human protein farnesyltransferase complexed with L-778,123 and FPP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X12B
Synchrotron site	NSLS
Beamline	X12B
Temperature [K]	100
Detector technology	CCD
Collection date	1999-10-02
Detector	ADSC QUANTUM 4
Spacegroup name	P 61
Unit cell lengths	178.247, 178.247, 64.518
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	36.670 - 1.900
R-factor	0.161
Rwork	0.161
R-free	0.18400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1jcq
RMSD bond length	0.009
RMSD bond angle	1.300
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	CNS (1.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.970
High resolution limit [Å]	1.900	1.900
Number of reflections	88408
<I/σ(I)>	31.1	10.5
Completeness [%]	96.3	76

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		5.7	290	14% PEG 8000, 400 mM ammonium acetate pH 5.7, 20 mM DTT , VAPOR DIFFUSION, HANGING DROP, temperature 290K, pH 5.70