2025-07-12_00000071
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ligand
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9FZR
Wild-type EGFR in covalent complex with Poziotinib analogue;
X-ray diffraction 1.99Å
Protein #1
329 residues (98% resolved)
Raw Sequence ...
GPGEAPNQALLRILKETEFKKIKVLGSGAFGTVYKGLWIPEGEKVKIPVAIKELREATSPKANKEILDEAYVMASVDNPHVCRLLGICLTSTVQLITQLMPFGCLLDYVREHKDNIGSQYLLNWCVQIAKGMNYLEDRRLVHRDLAARNVLVKTPQHVKITDFGLAKLLGAEEKEYHAEGGKVPIKWMALESILHRIYTHQSDVWSYGVTVWELMTFGSKPYDGIPASEISSILEKGERLPQPPICTIDVYMIMVKCWMIDADSRPKFRELIIEFSKMARDPQRYLVIQGDERMHLPSPTDSNFYRALMDEEDMDDVVDADEYLIPQQG
Canonical Sequence ...
GPGEAPNQALLRILKETEFKKIKVLGSGAFGTVYKGLWIPEGEKVKIPVAIKELREATSPKANKEILDEAYVMASVDNPHVCRLLGICLTSTVQLITQLMPFGCLLDYVREHKDNIGSQYLLNWCVQIAKGMNYLEDRRLVHRDLAARNVLVKTPQHVKITDFGLAKLLGAEEKEYHAEGGKVPIKWMALESILHRIYTHQSDVWSYGVTVWELMTFGSKPYDGIPASEISSILEKGERLPQPPICTIDVYMIMVKCWMIDADSRPKFRELIIEFSKMARDPQRYLVIQGDERMHLPSPTDSNFYRALMDEEDMDDVVDADEYLIPQQG
Non polymer #2
A1IHC
InChI=1S/C22H22ClFN4O3/c1-3-21(29)28-7-6-14(11-28)31-20-9-15-18(10-19(20)30-2)25-12-26-22(15)27-13-4-5-17(24)16(23)8-13/h4-5,8-10,12,14H,3,6-7,11H2,1-2H3,(H,25,26,27)/t14-/m0/s1
InChI=1S/C22H22ClFN4O3/c1-3-21(29)28-7-6-14(11-28)31-20-9-15-18(10-19(20)30-2)25-12-26-22(15)27-13-4-5-17(24)16(23)8-13/h4-5,8-10,12,14H,3,6-7,11H2,1-2H3,(H,25,26,27)/t14-/m0/s1
SMILES: CCC(=O)N1CC[C@@H](C1)Oc2cc3c(cc2OC)ncnc3Nc4ccc(c(c4)Cl)F
CCC(=O)N1CC[C@@H](C1)Oc2cc3c(cc2OC)ncnc3Nc4ccc(c(c4)Cl)F
Biounit #1
monomer
Download coordinates
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Model
Reference
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