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TitleEstimation of Hydrogen-Exchange Protection Factors from MD Simulation Based on Amide Hydrogen Bonding Analysis.
Journal, issue, pagesJ. Chem. Inf. Model., Vol. 55, Page 1914-1925, Year 2015
Publish dateApr 1, 2015 (structure data deposition date)
AuthorsPark, I.H. / Venable, J.D. / Steckler, C. / Cellitti, S.E. / Lesley, S.A. / Spraggon, G. / Brock, A.
External linksJ. Chem. Inf. Model. / PubMed:26241692
MethodsX-ray diffraction
Resolution1.7 Å
Structure data

PDB-4z49:
Homo Sapiens Fatty Acid Synthetase, Thioesterase Domain at 1.7 Angstroms Resolution
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

Chemicals

ChemComp-K:
Unknown entry

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE / Fatty Acid Synthetase / Thioesterase / FAS-TE

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