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4JIF

Co-crystal structure of ICAP1 PTB domain in complex with a KRIT1 peptide

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X29A
Synchrotron siteNSLS
BeamlineX29A
Temperature [K]93
Detector technologyCCD
Collection date2012-03-01
DetectorADSC QUANTUM 315
Wavelength(s)1.075
Spacegroup nameP 65 2 2
Unit cell lengths81.017, 81.017, 89.583
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution32.666 - 1.701
R-factor0.1971
Rwork0.196
R-free0.22630
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4dx8
RMSD bond length0.007
RMSD bond angle1.070
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwarePHENIX ((phenix.refine: 1.7.3_928))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]35.0001.760
High resolution limit [Å]1.7001.700
Number of reflections19541
Completeness [%]100
Redundancy12.412.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP29818-20%PEG3350, 0.2M MgCl2, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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