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5AMU

IglE I39A,Y40A,V44A

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Temperature [K]113
Spacegroup nameP 21 21 2
Unit cell lengths74.560, 53.780, 51.160
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution21.820 - 2.200
R-factor0.2017
Rwork0.198
R-free0.26499
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5amt
RMSD bond length0.015
RMSD bond angle1.718
Data reduction softwareiMOSFLM
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwareREFMAC (5.7.0029)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]22.0702.320
High resolution limit [Å]2.2002.200
Rmerge0.0800.380
Number of reflections10932
<I/σ(I)>11.43.6
Completeness [%]99.8100
Redundancy4.64.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1

221051

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