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1U54

Crystal Structures of the Phosphorylated and Unphosphorylated Kinase Domains of the CDC42-associated Tyrosine Kinase ACK1 bound to AMP-PCP

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL11-1
Synchrotron siteSSRL
BeamlineBL11-1
Temperature [K]100
Detector technologyCCD
Collection date2003-01-21
DetectorADSC QUANTUM 315
Spacegroup nameC 1 2 1
Unit cell lengths200.384, 42.332, 70.848
Unit cell angles90.00, 96.28, 90.00
Refinement procedure
Resolution38.710 - 2.800
R-factor0.226
Rwork0.222
R-free0.32200
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1u46
RMSD bond length0.019
RMSD bond angle1.972
Data reduction softwared*TREK
Data scaling softwared*TREK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.1.24)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]38.7102.900
High resolution limit [Å]2.8002.800
Number of reflections14697
<I/σ(I)>12.93.7
Completeness [%]98.397.8
Redundancy3.63.64
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
18.5291PEG 4000, lithium sulfate, magnesium chloride, sodium chloride, AMP-PCP, Tris, TCEP, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 291K, pH 8.50

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