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1TAW

BOVINE TRYPSIN COMPLEXED TO APPI

Experimental procedure
Source typeROTATING ANODE
Source detailsRIGAKU RUH2R
Temperature [K]277
Detector technologyDIFFRACTOMETER
Collection date1992-01
DetectorENRAF-NONIUS FAST
Spacegroup nameC 1 2 1
Unit cell lengths94.050, 49.850, 68.800
Unit cell angles90.00, 96.31, 90.00
Refinement procedure
Resolution8.000 - 1.800
R-factor0.184
Rwork0.184
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2ptc
RMSD bond length0.008
RMSD bond angle25.986

*

Data reduction softwarePROCOR
Data scaling softwarePROCOR
Phasing softwareX-PLOR (3.1)
Refinement softwareX-PLOR (3.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.000
High resolution limit [Å]1.8001.800
Rmerge0.059

*

0.080
Number of reflections22374
<I/σ(I)>102
Completeness [%]76.679.3
Redundancy32
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

*

6.54

*

used to seeding

*

Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein40 (M)
21reservoirPEG340025 (%(w/v))
31reservoirammonium acetate200 (mM)
41reservoirsodium citrate100 (mM)

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