2XVU

Human serum albumin complexed with dansyl-L-asparagine

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	2007-03-21
Detector	ADSC QUANTUM 4
Spacegroup name	P 1
Unit cell lengths	54.850, 55.250, 119.730
Unit cell angles	81.34, 90.93, 64.60

Refinement procedure

Resolution	35.120 - 2.600
R-factor	0.205
Rwork	0.205
R-free	0.24400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2bxa
RMSD bond length	0.007
RMSD bond angle	1.200
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	CNS
Refinement software	CNS (1.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	35.100	2.760
High resolution limit [Å]	2.600	2.600
Rmerge	0.050	0.380
Number of reflections	37571
<I/σ(I)>	10.4	2
Completeness [%]	97.7	97.4
Redundancy	2	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7		SEE PAPER, pH 7