4Z69

Human serum albumin complexed with palmitic acid and diclofenac

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2014-10-22
Detector	ADSC QUANTUM 315r
Wavelength(s)	1
Spacegroup name	P 1
Unit cell lengths	38.396, 95.003, 96.339
Unit cell angles	105.00, 101.45, 89.97

Refinement procedure

Resolution	45.817 - 2.187
R-factor	0.2287
Rwork	0.225
R-free	0.29300
RMSD bond length	0.008
RMSD bond angle	1.224
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.6_289)

Data quality characteristics

	Overall
Low resolution limit [Å]	45.817
High resolution limit [Å]	2.187
<I/σ(I)>	2.1
Completeness [%]	98.0
Redundancy	3.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	285	PEG 3350, potassium phosphate, glycerol, DMSO