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3D5H

Crystal structure of haementhin from Haemanthus multiflorus at 2.0A resolution: Formation of a novel loop on a TIM barrel fold and its functional significance

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU300
Temperature [K]293
Detector technologyIMAGE PLATE
Collection date2007-10-15
DetectorMAR scanner 345 mm plate
Wavelength(s)1.54132
Spacegroup nameP 1 21 1
Unit cell lengths42.803, 65.400, 49.435
Unit cell angles90.00, 102.00, 90.00
Refinement procedure
Resolution48.220 - 2.000
R-factor0.15372
Rwork0.152
R-free0.18632
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2hvm
RMSD bond length0.016
RMSD bond angle1.811
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]48.2242.050
High resolution limit [Å]2.0002.000
Number of reflections16787
Completeness [%]97.597.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.22980.1M ammonium sulphate, 20% PEG 6000, 0.1M sodium acetate, 20mM phosphate buffer, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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