2026-10-17_00000009
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ligand
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12WW
FGFR3 Kinase Domain with Inhibitor 4-[4-[3-chloro-4-[(1S)-1-(5-fluoro-2-pyridinyl)-2-hydroxyethoxy]pyrazolo[5-a]pyridin-6-yl]-5-methyltriazol-1-yl]piperidine-1-carbonitrile;
X-ray diffraction 2.04Å
Protein #1
312 residues (96% resolved)
Raw Sequence ...
GPTLANVSELELPADPKWELSRARLTLGKPLGEGAFGQVVMAEAIGIDKDRAAKPVTVAVKMLKDDATDKDLSDLVSEMEMMKMIGKHKNIINLLGACTQGGPLYVLVEYAAKGNLREFLRARRPPGLD(PTR)SFDTCKPPEEQLTFKDLVSCAYQVARGMEYLASQKCIHRDLAARNVLVTEDNVMKIADFGLARDVHNLD(PTR)(PTR)KETTNGRLPVKWMAPEALFDRVYTHQSDVWSFGVLLWEIFTLGGSPYPGIPVEELFKLLKEGHRMDKPANCTHDLYMIMRECWHAAPSQRPTFKQLVEDLDRVLTVTSTDE
Canonical Sequence ...
GPTLANVSELELPADPKWELSRARLTLGKPLGEGAFGQVVMAEAIGIDKDRAAKPVTVAVKMLKDDATDKDLSDLVSEMEMMKMIGKHKNIINLLGACTQGGPLYVLVEYAAKGNLREFLRARRPPGLDYSFDTCKPPEEQLTFKDLVSCAYQVARGMEYLASQKCIHRDLAARNVLVTEDNVMKIADFGLARDVHNLDYYKETTNGRLPVKWMAPEALFDRVYTHQSDVWSFGVLLWEIFTLGGSPYPGIPVEELFKLLKEGHRMDKPANCTHDLYMIMRECWHAAPSQRPTFKQLVEDLDRVLTVTSTDE
Non polymer #2
A1DC5
InChI=1S/C23H24ClFN8O2/c1-14-22(29-30-33(14)17-4-6-31(13-26)7-5-17)15-8-20(23-18(24)10-28-32(23)11-15)35-21(12-34)19-3-2-16(25)9-27-19/h2-3,8-11,13,17,21,26,34H,4-7,12H2,1H3/t21-/m1/s1
InChI=1S/C23H24ClFN8O2/c1-14-22(29-30-33(14)17-4-6-31(13-26)7-5-17)15-8-20(23-18(24)10-28-32(23)11-15)35-21(12-34)19-3-2-16(25)9-27-19/h2-3,8-11,13,17,21,26,34H,4-7,12H2,1H3/t21-/m1/s1
SMILES: Cc1c(nnn1C2CCN(CC2)C=N)c3cc(c4c(cnn4c3)Cl)O[C@H](CO)c5ccc(cn5)F
Cc1c(nnn1C2CCN(CC2)C=N)c3cc(c4c(cnn4c3)Cl)O[C@H](CO)c5ccc(cn5)F
Biounit #1
monomer
Download coordinates
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Model
Reference
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