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2Z5Y

Crystal Structure of Human Monoamine Oxidase A (G110A) with Harmine

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL44XU
Synchrotron siteSPring-8
BeamlineBL44XU
Temperature [K]100
Detector technologyCCD
Collection date2006-07-12
DetectorBruker DIP-6040
Wavelength(s)0.9
Spacegroup nameC 2 2 2
Unit cell lengths135.547, 217.364, 54.804
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution44.240 - 2.170
R-factor0.19592
Rwork0.193
R-free0.24358
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1o5w
RMSD bond length0.019
RMSD bond angle1.812
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.3.0021)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]49.5702.250
High resolution limit [Å]2.1602.160
Rmerge0.0790.310
Number of reflections31614
<I/σ(I)>7.11.5
Completeness [%]71.421.5
Redundancy2.81.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP52771.6M AMMONIUM SULFATE, 100mM CITRIC ACID, pH 5.00, VAPOR DIFFUSION, SITTING DROP, temperature 277K

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