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7QC8

HisF-C9A-D11E-V33A_L50H_I52H mutant in complex with Zn(II) from T. maritima

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Temperature [K]100
Detector technologyPIXEL
Collection date2016-10-15
DetectorDECTRIS EIGER X 16M
Wavelength(s)1
Spacegroup nameP 61 2 2
Unit cell lengths96.680, 96.680, 154.420
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution15.000 - 1.800
R-factor0.1393
Rwork0.138
R-free0.15920
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)7qc3
RMSD bond length0.008
RMSD bond angle1.275
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareREFMAC
Refinement softwareREFMAC (5.8.0158)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.900
High resolution limit [Å]1.8001.800
Rmerge0.0660.596
Number of reflections391475862
<I/σ(I)>25.34.4
Completeness [%]97.499.4
Redundancy12.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP8.3292100 mM TRIS, 23% PEG 3350

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