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Structure paper

TitleStructures of drug-specific monoclonal antibodies bound to opioids and nicotine reveal a common mode of binding.
Journal, issue, pagesStructure, Vol. 31, Page 20-32.e5, Year 2023
Publish dateMar 3, 2022 (structure data deposition date)
AuthorsRodarte, J.V. / Baehr, C. / Hicks, D. / Liban, T.L. / Weidle, C. / Rupert, P.B. / Jahan, R. / Wall, A. / McGuire, A.T. / Strong, R.K. ...Rodarte, J.V. / Baehr, C. / Hicks, D. / Liban, T.L. / Weidle, C. / Rupert, P.B. / Jahan, R. / Wall, A. / McGuire, A.T. / Strong, R.K. / Runyon, S. / Pravetoni, M. / Pancera, M.
External linksStructure / PubMed:36513069
MethodsX-ray diffraction
Resolution1.75 - 2.3 Å
Structure data

PDB-7u61:
Crystal Structure of Anti-Nicotine Antibody NIC311 Fab Complexed with Nicotine
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-7u62:
Crystal structure of Anti-Heroin Antibody HY4-1F9 Fab Complexed with Morphine
Method: X-RAY DIFFRACTION / Resolution: 1.82 Å

PDB-7u63:
Crystal Structure Anti-Oxycodone Antibody HY2-A12 Fab Complexed with Oxycodone
Method: X-RAY DIFFRACTION / Resolution: 2.3 Å

PDB-7u64:
Crystal Structure of Anti-Fentanyl Antibody HY6-F9.6 Fab Complexed with Fentanyl
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

Chemicals

ChemComp-NCT:
(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE / alkaloid*YM

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

ChemComp-MOI:
(7R,7AS,12BS)-3-METHYL-2,3,4,4A,7,7A-HEXAHYDRO-1H-4,12-METHANO[1]BENZOFURO[3,2-E]ISOQUINOLINE-7,9-DIOL

ChemComp-ACT:
ACETATE ION

ChemComp-OOX:
14-hydroxy-3-methoxy-17-methyl-5beta-4,5-epoxymorphinan-6-one

ChemComp-7V7:
N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide / medication*YM

ChemComp-NA:
Unknown entry

Source
  • mus musculus (house mouse)
KeywordsIMMUNE SYSTEM / mAb / opioid

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