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3KD7

Designed TPR module (CTPR390) in complex with its peptide-ligand (Hsp90 peptide)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X12C
Synchrotron siteNSLS
BeamlineX12C
Temperature [K]100
Detector technologyCCD
Collection date2004-04-20
Wavelength(s)1.1001
Spacegroup nameH 3
Unit cell lengths100.674, 100.674, 161.574
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution50.000 - 2.850
R-factor0.27114
Rwork0.271
R-free0.28255
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1na0
RMSD bond length0.005
RMSD bond angle0.708
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]76.7002.950
High resolution limit [Å]2.8502.850
Rmerge0.0750.397
Number of reflections13180
<I/σ(I)>21.181.16
Completeness [%]99.499.7
Redundancy5.35.28
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP1029550 mM NaH2PO4, 20% (w/v) PEG 20000, 50 mM CAPS, pH 10.0, VAPOR DIFFUSION, SITTING DROP, temperature 295K

222036

PDB entries from 2024-07-03

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