2025-01-25_00000244|ligand|9FUG

Crystal structure of SNAr1.3 (K39A) in complex with 2,4-dinitroiodobenzene; X-ray diffraction 1.71Å
Protein #1 242 residues (95% resolved)

MIRAVFFDSLGTLISVEGAYKVRLKIMEEVLGDYPLNPATLLDEYEKLAREAFSNYAGKPYRPMRDILEEVMRKLAEKYGFKYPENLREISLRMACRYGELYPEVVEVLKSLKGKYHVGDILQRDTEPATAFLDALGIKDLFDSITTSEEAGFFKPHPRIFELALKKAGVKGEKAVYVGDNPVKDAGGSKNLGMTSILLDRKGEKREFWDKADFIVSDLREVIKIVDELNGQGSLEHHHHHH

MIRAVFFDSLGTLISVEGAYKVRLKIMEEVLGDYPLNPATLLDEYEKLAREAFSNYAGKPYRPMRDILEEVMRKLAEKYGFKYPENLREISLRMACRYGELYPEVVEVLKSLKGKYHVGDILQRDTEPATAFLDALGIKDLFDSITTSEEAGFFKPHPRIFELALKKAGVKGEKAVYVGDNPVKDAGGSKNLGMTSILLDRKGEKREFWDKADFIVSDLREVIKIVDELNGQGSLEHHHHHH
Non polymer #2 A1IGD

InChI=1S/C6H3IN2O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H

c1cc(c(cc1[N+](=O)[O-])[N+](=O)[O-])I
Non polymer #3 CL

InChI=1S/ClH/h1H/p-1

[Cl-]
Non polymer #4 PEG

InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2

C(COCCO)O
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Reference