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7OQM

Human OMPD-domain of UMPS in complex with substrate OMP at 1.05 Angstroms resolution, 20 minutes soaking

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron sitePETRA III, EMBL c/o DESY
BeamlineP14 (MX2)
Temperature [K]100
Detector technologyPIXEL
Collection date2018-07-08
DetectorDECTRIS EIGER X 16M
Wavelength(s)0.827
Spacegroup nameP 1 21 1
Unit cell lengths69.964, 61.882, 70.052
Unit cell angles90.00, 113.09, 90.00
Refinement procedure
Resolution42.510 - 1.050
R-factor0.1216
Rwork0.121
R-free0.13360
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)6zwy
RMSD bond length0.007
RMSD bond angle1.468
Data reduction softwareXDS
Data scaling softwareXSCALE
Refinement softwareREFMAC (5.8.0258)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]42.51042.5101.080
High resolution limit [Å]1.0504.7001.050
Rmerge0.0500.0230.800
Rmeas0.0590.0270.963
Total number of observations868228
Number of reflections248705283617591
<I/σ(I)>12.3546.641.7
Completeness [%]97.294.993.3
Redundancy3.4913.4163.19
CC(1/2)0.9990.9990.661
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.8293.15Ammonium sulfate, Tris/HCl, Glutathion, Glycerol

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