2026-05-23_00000322
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ligand
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9VVE
Inhibition of PDE4 by Inhaled Small Molecules in COPD;
X-ray diffraction 3.51Å
Protein #1
377 residues (89% resolved)
Raw Sequence ...
SISRFGVNTENEDHLAKELEDLNKWGLNIFNVAGYSHNRPLTCIMYAIFQERDLLKTFRISSDTFITYMMTLEDHYHSDVAYHNSLHAADVAQSTHVLLSTPALDAVFTDLEILAAIFAAAIHDVDHPGVSNQFLINTNSELALMYNDESVLENHHLAVGFKLLQEEHCDIFMNLTKKQRQTLRKMVIDMVLATDMSKHMSLLADLKTMVETKKVTSSGVLLLDNYTDRIQVLRNMVHCADLSNPTKSLELYRQWTDRIMEEFFQQGDKERERGMEISPMCDKHTASVEKSQVGFIDYIVHPLWETWADLVQPDAQDILDTLEDNRNWYQSMIPQSPSPPLDEQNRDCQGLMEKFQFELTLDEEDSEGPEKEGEGHS
Canonical Sequence ...
SISRFGVNTENEDHLAKELEDLNKWGLNIFNVAGYSHNRPLTCIMYAIFQERDLLKTFRISSDTFITYMMTLEDHYHSDVAYHNSLHAADVAQSTHVLLSTPALDAVFTDLEILAAIFAAAIHDVDHPGVSNQFLINTNSELALMYNDESVLENHHLAVGFKLLQEEHCDIFMNLTKKQRQTLRKMVIDMVLATDMSKHMSLLADLKTMVETKKVTSSGVLLLDNYTDRIQVLRNMVHCADLSNPTKSLELYRQWTDRIMEEFFQQGDKERERGMEISPMCDKHTASVEKSQVGFIDYIVHPLWETWADLVQPDAQDILDTLEDNRNWYQSMIPQSPSPPLDEQNRDCQGLMEKFQFELTLDEEDSEGPEKEGEGHS
Non polymer #2
A1ETU
InChI=1S/C17H11Cl3N2O2/c1-24-15-4-2-9(10-3-5-16(20)22-17(10)15)14(23)6-11-12(18)7-21-8-13(11)19/h2-5,7-8H,6H2,1H3
InChI=1S/C17H11Cl3N2O2/c1-24-15-4-2-9(10-3-5-16(20)22-17(10)15)14(23)6-11-12(18)7-21-8-13(11)19/h2-5,7-8H,6H2,1H3
SMILES: COc1ccc(c2c1nc(cc2)Cl)C(=O)Cc3c(cncc3Cl)Cl
COc1ccc(c2c1nc(cc2)Cl)C(=O)Cc3c(cncc3Cl)Cl
Non polymer #3
MG
InChI=1S/Mg/q+2
InChI=1S/Mg/q+2
SMILES: [Mg+2]
[Mg+2]
Non polymer #4
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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