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4AKJ

Ligand controlled assembly of hexamers, dihexamers, and linear multihexamer structures by an engineered acylated insulin

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-007
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2005-07-05
DetectorMARRESEARCH
Spacegroup nameH 3
Unit cell lengths78.717, 78.717, 40.551
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution39.340 - 2.010
R-factor0.1979
Rwork0.196
R-free0.22943
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ev3
RMSD bond length0.018
RMSD bond angle1.801
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.6.0119)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]19.5302.030
High resolution limit [Å]2.0102.010
Rmerge0.0400.310
Number of reflections6176
<I/σ(I)>17.041.9
Completeness [%]97.575.7
Redundancy3.92.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
17.5pH 7.5

217705

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