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1WUP

Crystal structure of metallo-beta-lactamase IMP-1 mutant (D81E)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL40B2
Synchrotron siteSPring-8
BeamlineBL40B2
Temperature [K]100
Detector technologyCCD
Wavelength(s)0.98
Spacegroup nameP 1
Unit cell lengths49.213, 73.061, 80.890
Unit cell angles84.81, 76.10, 74.00
Refinement procedure
Resolution19.730 - 3.000
R-factor0.224
Rwork0.224
R-free0.29500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1dd6
RMSD bond length0.008
RMSD bond angle1.600
Data reduction softwareDENZO
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]99.0003.080
High resolution limit [Å]2.9702.970
Number of reflections19685
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.5297acetic-acetate, citrate, PEG4000, pH 6.50, VAPOR DIFFUSION, HANGING DROP, temperature 297K

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