1HK5

HUMAN SERUM ALBUMIN MUTANT R218H COMPLEXED WITH THYROXINE (3,3',5,5'-TETRAIODO-L-THYRONINE) and myristic acid (tetradecanoic acid)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SRS BEAMLINE PX9.6
Synchrotron site	SRS
Beamline	PX9.6
Temperature [K]	298
Detector technology	CCD
Collection date	1999-03-15
Detector	ADSC CCD
Spacegroup name	C 1 2 1
Unit cell lengths	190.140, 39.040, 96.230
Unit cell angles	90.00, 105.07, 90.00

Refinement procedure

Resolution	46.600 * - 2.800 *
R-factor	0.199
Rwork	0.199
R-free	0.25900
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1e7g
RMSD bond length	0.007
RMSD bond angle	1.260 *
Data reduction software	MOSFLM
Data scaling software	CCP4
Phasing software	CNS
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.600	2.850
High resolution limit [Å]	2.800	2.800
Rmerge	0.082	0.309
Number of reflections	17211
<I/σ(I)>	5.6	1.8
Completeness [%]	90.0	80
Redundancy	2.4	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, sitting drop *	7		pH 7.00

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	100 (mg/ml)
2	1	drop	potassium phosphate	20 (mM)	pH7.0-7.5