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8Y22

FGFR1 kinase domain with a covalent inhibitor 9g

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsCu FINE FOCUS
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2022-05-17
DetectorRIGAKU
Wavelength(s)1.5870
Spacegroup nameC 1 2 1
Unit cell lengths210.105, 56.922, 65.066
Unit cell angles90.00, 107.47, 90.00
Refinement procedure
Resolution46.381 - 2.792
R-factor0.1973
Rwork0.194
R-free0.25970
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)7wcl
RMSD bond length0.005
RMSD bond angle0.766
Data reduction softwareHKL-3000
Data scaling softwareHKL-2000
Phasing softwarePHENIX
Refinement softwarePHENIX (1.9_1692)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]46.3812.892
High resolution limit [Å]2.7922.792
Rmeas0.225
Number of reflections179361467
<I/σ(I)>82.9
Completeness [%]96.980.08
Redundancy6.7
CC(1/2)0.9860.791
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP27718% PEG 8000, 0.2 M Li2SO4, and 0.1 M MES, pH 6.5

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