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9E3S

Tricomplex of RMC-9945, KRAS G12N, and CypA

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 5.0.2
Synchrotron siteALS
Beamline5.0.2
Temperature [K]100
Detector technologyPIXEL
Collection date2023-03-23
DetectorDECTRIS PILATUS3 6M
Wavelength(s)1.00004
Spacegroup nameP 1 21 1
Unit cell lengths47.920, 101.500, 66.800
Unit cell angles90.00, 90.64, 90.00
Refinement procedure
Resolution43.330 - 1.080
R-factor0.1525
Rwork0.151
R-free0.17780
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.006
RMSD bond angle1.067
Data reduction softwareHKL-2000
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwarePHENIX (1.20.1_4487)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]43.3301.190
High resolution limit [Å]1.0801.080
Rmerge0.980
Number of reflections25537819081
<I/σ(I)>8.23
Completeness [%]93.8
Redundancy3.3
CC(1/2)0.9980.326
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2910.1 M MES 6 pH, 0.1-0.2 M NaCl, 21-26 %w/v PEG 3350

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