2024-06-29_00000072
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hard
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8QAE
X-ray crystal structure of a de novo designed single-chain antiparallel 6-helix alpha-helical barrel, sc-apCC-6-SLLA;
X-ray diffraction 1.90Å
Protein #1
234 residues (91% resolved)
Raw Sequence ...
MGSSHHHHHHSSGLVPRGSHMMGSLEELAQSLEELAKSLKKLAWSLKKLAQGAQPLEMSLEELAQSLEELAKSLKKLAWSLKKLAQTTETKKQGDSLEELAQSLEELAKSLKKLAWSLKKLAQQYGDKRTSLEELAQSLEELAKSLKKLAWSLKKLAQVAPTQRHRYSLEELAQSLEELAKSLKKLAWSLKKLAQGTNSDSDLKSSLEELAQSLEELAKSLKKLAWSLKKLAQG
Canonical Sequence ...
MGSSHHHHHHSSGLVPRGSHMMGSLEELAQSLEELAKSLKKLAWSLKKLAQGAQPLEMSLEELAQSLEELAKSLKKLAWSLKKLAQTTETKKQGDSLEELAQSLEELAKSLKKLAWSLKKLAQQYGDKRTSLEELAQSLEELAKSLKKLAWSLKKLAQVAPTQRHRYSLEELAQSLEELAKSLKKLAWSLKKLAQGTNSDSDLKSSLEELAQSLEELAKSLKKLAWSLKKLAQG
Non polymer #2
1PE
InChI=1S/C10H22O6/c11-1-3-13-5-7-15-9-10-16-8-6-14-4-2-12/h11-12H,1-10H2
InChI=1S/C10H22O6/c11-1-3-13-5-7-15-9-10-16-8-6-14-4-2-12/h11-12H,1-10H2
SMILES: C(COCCOCCOCCOCCO)O
C(COCCOCCOCCOCCO)O
Non polymer #3
P5R
InChI=1S/C34H70O18/c35-1-3-37-5-7-39-9-11-41-13-15-43-17-19-45-21-23-47-25-27-49-29-31-51-33-34-52-32-30-50-28-26-48-24-22-46-20-18-44-16-14-42-12-10-40-8-6-38-4-2-36/h35-36H,1-34H2
InChI=1S/C34H70O18/c35-1-3-37-5-7-39-9-11-41-13-15-43-17-19-45-21-23-47-25-27-49-29-31-51-33-34-52-32-30-50-28-26-48-24-22-46-20-18-44-16-14-42-12-10-40-8-6-38-4-2-36/h35-36H,1-34H2
SMILES: C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O
C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O
Biounit #1
monomer
Download coordinates
Biounit #2
homo-dimer
Download coordinates
Tube
Model
Reference
100%