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8EVM

De novo design of chlorophyll special pair containing protein assemblies

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 5.0.1
Synchrotron siteALS
Beamline5.0.1
Temperature [K]100
Detector technologyPIXEL
Collection date2020-10-23
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.97741
Spacegroup nameP 31 2 1
Unit cell lengths88.732, 88.732, 149.484
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution44.370 - 3.050
R-factor0.253
Rwork0.248
R-free0.29730
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)Designed Protein
RMSD bond length0.002
RMSD bond angle0.517
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwarePHENIX (1.18rc2_3793)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]44.3703.150
High resolution limit [Å]3.0503.050
Rmerge0.194
Number of reflections134831311
<I/σ(I)>11.540.62
Completeness [%]99.496.27
Redundancy10.810.7
CC(1/2)0.9990.248
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP72932.4 M Sodium malonate dibasic monohydrate pH 7.0

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