2024-10-05_00000169|ligand|9BHJ

MerTK in complex with small molecule 6-{1-[([1,1'-biphenyl]-4-yl)carbamoyl]azetidin-3-yl}-3-[(1-methyl-1H-pyrazol-4-yl)amino]pyrazine-2-carboxamide; X-ray diffraction 2.29Å
Protein #1 323 residues (88% resolved)

MSYYHHHHHHDYDIPTTENLYFQGAMDPEDVVIDRNLLILGKILGEGEFGSVMEGNLKQEDGTSLKVAVKTMKLDNSSQREIEEFLSEAACMKDFSHPNVIRLLGVCIEMSSQGIPKPMVILPFMKYGDLHTYLLYSRLETGPKHIPLQTLLKFMVDIALGMEYLSNRNFLHRDLAARNCMLRDDMTVCVADFGLSKKIYSGDYYRQGRIAKMPVKWIAIESLADRVYTSKSDVWAFGVTMWEIATRGMTPYPGVQNHEMYDYLLHGHRLKQPEDCLDELYEIMYSCWRTDPLDRPTFSVLRLQLEKLLESLPDVRNQADVIY

MSYYHHHHHHDYDIPTTENLYFQGAMDPEDVVIDRNLLILGKILGEGEFGSVMEGNLKQEDGTSLKVAVKTMKLDNSSQREIEEFLSEAACMKDFSHPNVIRLLGVCIEMSSQGIPKPMVILPFMKYGDLHTYLLYSRLETGPKHIPLQTLLKFMVDIALGMEYLSNRNFLHRDLAARNCMLRDDMTVCVADFGLSKKIYSGDYYRQGRIAKMPVKWIAIESLADRVYTSKSDVWAFGVTMWEIATRGMTPYPGVQNHEMYDYLLHGHRLKQPEDCLDELYEIMYSCWRTDPLDRPTFSVLRLQLEKLLESLPDVRNQADVIY
Non polymer #2 A1APG

InChI=1S/C25H24N8O2/c1-32-15-20(11-28-32)29-24-22(23(26)34)31-21(12-27-24)18-13-33(14-18)25(35)30-19-9-7-17(8-10-19)16-5-3-2-4-6-16/h2-12,15,18H,13-14H2,1H3,(H2,26,34)(H,27,29)(H,30,35)

Cn1cc(cn1)Nc2c(nc(cn2)C3CN(C3)C(=O)Nc4ccc(cc4)c5ccccc5)C(=O)N
Non polymer #3 CL

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

[Cl-]
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Reference