5BMY

Crystal structure of hPin1 WW domain (5-21) fused with maltose-binding protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2012-05-18
Detector	RIGAKU RAXIS VII
Wavelength(s)	1.5418
Spacegroup name	P 21 21 21
Unit cell lengths	51.155, 72.969, 100.818
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.704 - 2.001
R-factor	0.1557
Rwork	0.154
R-free	0.19370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1anf
RMSD bond length	0.007
RMSD bond angle	1.071
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHENIX
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.000
Number of reflections	26164
<I/σ(I)>	33.2
Completeness [%]	99.8
Redundancy	7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	2.1 M DL-malic acid