3L42

PWWP domain of human bromodomain and PHD finger containing protein 1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2009-08-05
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97711
Spacegroup name	P 43 21 2
Unit cell lengths	44.352, 44.352, 122.722
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 1.300
R-factor	0.21
Rwork	0.209
R-free	0.23300
Structure solution method	SAD
RMSD bond length	0.016
RMSD bond angle	1.632
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SHELX
Refinement software	REFMAC (5.5.0102)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	40.000	40.000	1.320
High resolution limit [Å]	1.300	3.530	1.300
Rmerge	0.056	0.039	0.465
Number of reflections	31403
<I/σ(I)>	12.2
Completeness [%]	99.9	98.5	100
Redundancy	14.5	13.4	13.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	8.5	291	3.5M sodium formate, 0.1M TRIS-hydrochloride, pH 8.5, vapor diffusion, temperature 291K
2	VAPOR DIFFUSION	7.5	291	25% PEG3350, 0.1M ammonium sulfate, 0.1M HEPES, pH 7.5, vapor diffusion, temperature 291K