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2OTV

Crystal structure of the complex formed between bovine trypsin and nicotinamide at 1.56 A resolution

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU300
Temperature [K]292
Detector technologyIMAGE PLATE
Collection date2007-01-18
DetectorMAR scanner 345 mm plate
Wavelength(s)1.54132
Spacegroup nameP 21 21 21
Unit cell lengths54.831, 58.579, 67.461
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution44.280 - 1.560
R-factor0.16883
Rwork0.168
R-free0.18586
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2ayw
RMSD bond length0.010
RMSD bond angle1.313
Data reduction softwareAUTOMAR
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]44.2801.600
High resolution limit [Å]1.5601.560
Number of reflections29751
Completeness [%]99.099.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.2298Ammonium sulphate, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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