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5CSK

Crystal structure of yeast acetyl-CoA carboxylase, unbiotinylated

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X25
Synchrotron siteNSLS
BeamlineX25
Temperature [K]100
Detector technologyPIXEL
Collection date2014-07-29
DetectorPSI PILATUS 6M
Wavelength(s)1.100
Spacegroup nameP 43 21 2
Unit cell lengths159.879, 159.879, 615.490
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution49.470 - 3.100
R-factor0.2199
Rwork0.217
R-free0.28080
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)AC1-2 AC3-5 BT-BCCP-AC1-5
RMSD bond length0.011
RMSD bond angle1.494
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwareREFMAC (5.7.0029)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0003.210
High resolution limit [Å]3.1006.6703.100
Rmerge0.1090.0360.881
Rmeas0.1270.046
Rpim0.0850.0290.680
Total number of observations307202
Number of reflections136014
<I/σ(I)>6.4
Completeness [%]93.192.290.5
Redundancy2.32.22.3
CC(1/2)0.9960.452
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP8.329314% (w/v) PEG3350, 4% (v/v) tert-butanol, and 0.2 M sodium citrate

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