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4MX3

Crystal Structure of PKA RIalpha Homodimer

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.2.1
Synchrotron siteALS
Beamline8.2.1
Temperature [K]200
Detector technologyCCD
Collection date2011-09-19
DetectorADSC QUANTUM 315
Wavelength(s)1.0
Spacegroup nameP 41 21 2
Unit cell lengths104.672, 104.672, 218.327
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.000 - 3.880
R-factor0.26082
Rwork0.260
R-free0.28671
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1rgs
RMSD bond length0.017
RMSD bond angle1.853
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASES
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0004.020
High resolution limit [Å]3.8803.880
Rmerge0.0880.575
Number of reflections11860
<I/σ(I)>35.96.2
Completeness [%]99.9100
Redundancy99.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP52980.125 M sodium acetate (pH 5), 2M sodium formate with the protein at a final concentration of 4 mg/ml grown in a 2 ul drop, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K

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