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TitleDynamic design: manipulation of millisecond timescale motions on the energy landscape of cyclophilin A
Journal, issue, pagesChem Sci, Year 2020
Publish dateJun 13, 2018 (structure data deposition date)
AuthorsJuarez-Jimenez, J. / Gupta, A.A. / Karunanithy, G. / May, A. / Georgiou, C. / Ioannidis, H. / De Simone, A. / Barlow, P.N. / Hulme, A.N. / Walkinshaw, M.D. ...Juarez-Jimenez, J. / Gupta, A.A. / Karunanithy, G. / May, A. / Georgiou, C. / Ioannidis, H. / De Simone, A. / Barlow, P.N. / Hulme, A.N. / Walkinshaw, M.D. / Baldwin, A. / Michel, J.
External linksChem Sci / Search PubMed
MethodsX-ray diffraction
Resolution1.16 Å
Structure data

PDB-6gs6:
Cyclophilin A single mutant D66A in complex with an inhibitor.
Method: X-RAY DIFFRACTION / Resolution: 1.16 Å

Chemicals

ChemComp-EA4:
ethyl N-[(4-aminobenzyl)carbamoyl]glycinate

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsISOMERASE / Cyclophilins / CypA / CypA mutant / inhibitor / PPIase / complex

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