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4S0O

Crystal Structure of the Autoinhibited Dimer of Pro-apoptotic BAX (I)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X29A
Synchrotron siteNSLS
BeamlineX29A
Temperature [K]100
Detector technologyCCD
Collection date2012-03-15
DetectorADSC QUANTUM 315
Spacegroup nameP 1 21 1
Unit cell lengths63.657, 40.276, 65.303
Unit cell angles90.00, 90.02, 90.00
Refinement procedure
Resolution19.150 - 1.900
R-factor0.212
Rwork0.209
R-free0.26500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1f16
RMSD bond length0.023
RMSD bond angle1.856
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Refinement softwareREFMAC (5.5.0072)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.930
High resolution limit [Å]1.9001.900
Rmerge0.0600.600
Number of reflections24766
<I/σ(I)>21.72.3
Completeness [%]95.098
Redundancy4.64.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.22931.6 M AMMONIUM SULFATE, 0.1 M BIS-TRIS , PH 6.2, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 293K

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