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9U7S

FGFR2 kinase domain with a macrocyclic compound 8r

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL02U1
Synchrotron siteSSRF
BeamlineBL02U1
Temperature [K]80
Detector technologyCCD
Collection date2024-04-13
DetectorADSC QUANTUM 315r
Wavelength(s)0.97918
Spacegroup nameP 21 21 21
Unit cell lengths60.800, 72.820, 137.880
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution31.240 - 1.990
R-factor0.1831
Rwork0.181
R-free0.22500
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.010
RMSD bond angle1.163
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHENIX
Refinement softwarePHENIX ((1.19.2_4158: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]31.2402.061
High resolution limit [Å]1.9901.990
Number of reflections428004237
<I/σ(I)>12.792.73
Completeness [%]99.9100
Redundancy13.112.9
CC(1/2)0.9980.782
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP293.1518% PEG 3350, 100 mM (NH4)2SO4, 100 mM HEPES, pH 7.5

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