2025-12-20_00000040
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ligand
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9HMD
Crystal structure of PDE6D in complex with DeltaTag (6a);
X-ray diffraction 2.50Å
Protein #1
156 residues (96% resolved)
Raw Sequence ...
HHHHHHMSAKDERAREILRGFKLNWMNLRDAETGKILWQGTEDLSVPGVEHEARVPKKILKCKAVSRELNFSSTEQMEKFRLEQKVYFKGQCLEEWFFEFGFVIPNSTNTWQSLIEAAPESQMMPASVLTGNVIIETKFFDDDLLVSTSRVRLFYV
Canonical Sequence ...
HHHHHHMSAKDERAREILRGFKLNWMNLRDAETGKILWQGTEDLSVPGVEHEARVPKKILKCKAVSRELNFSSTEQMEKFRLEQKVYFKGQCLEEWFFEFGFVIPNSTNTWQSLIEAAPESQMMPASVLTGNVIIETKFFDDDLLVSTSRVRLFYV
Non polymer #2
A1IWD
InChI=1S/C34H46N6O3S/c1-5-28-9-8-10-29(23-28)17-21-38(24-30-15-18-35-19-16-30)44(42,43)22-7-6-20-39-34(41)33-32(26(3)36-39)27(4)40(37-33)31-13-11-25(2)12-14-31/h8-14,23,30,35H,5-7,15-22,24H2,1-4H3
InChI=1S/C34H46N6O3S/c1-5-28-9-8-10-29(23-28)17-21-38(24-30-15-18-35-19-16-30)44(42,43)22-7-6-20-39-34(41)33-32(26(3)36-39)27(4)40(37-33)31-13-11-25(2)12-14-31/h8-14,23,30,35H,5-7,15-22,24H2,1-4H3
SMILES: CCc1cccc(c1)CCN(CC2CCNCC2)S(=O)(=O)CCCCN3C(=O)c4c(c(n(n4)c5ccc(cc5)C)C)C(=N3)C
CCc1cccc(c1)CCN(CC2CCNCC2)S(=O)(=O)CCCCN3C(=O)c4c(c(n(n4)c5ccc(cc5)C)C)C(=N3)C
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
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