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Structure paper

TitleStructural basis for dual-mode inhibition of the ABC transporter MsbA.
Journal, issue, pagesNature, Vol. 557, Page 196-201, Year 2018
Publish dateNov 23, 2017 (structure data deposition date)
AuthorsHo, H. / Miu, A. / Alexander, M.K. / Garcia, N.K. / Oh, A. / Zilberleyb, I. / Reichelt, M. / Austin, C.D. / Tam, C. / Shriver, S. ...Ho, H. / Miu, A. / Alexander, M.K. / Garcia, N.K. / Oh, A. / Zilberleyb, I. / Reichelt, M. / Austin, C.D. / Tam, C. / Shriver, S. / Hu, H. / Labadie, S.S. / Liang, J. / Wang, L. / Wang, J. / Lu, Y. / Purkey, H.E. / Quinn, J. / Franke, Y. / Clark, K. / Beresini, M.H. / Tan, M.W. / Sellers, B.D. / Maurer, T. / Koehler, M.F.T. / Wecksler, A.T. / Kiefer, J.R. / Verma, V. / Xu, Y. / Nishiyama, M. / Payandeh, J. / Koth, C.M.
External linksNature / PubMed:29720648
MethodsX-ray diffraction
Resolution2.908 - 2.92 Å
Structure data

PDB-6bpl:
E. coli MsbA in complex with LPS and inhibitor G907
Method: X-RAY DIFFRACTION / Resolution: 2.908 Å

PDB-6bpp:
E. coli MsbA in complex with LPS and inhibitor G092
Method: X-RAY DIFFRACTION / Resolution: 2.92 Å

Chemicals

ChemComp-3PE:
1,2-Distearoyl-sn-glycerophosphoethanolamine / phospholipid*YM

ChemComp-AU7:
(2E)-3-{6-[(1S)-1-(2-chloro-6-cyclopropylphenyl)ethoxy]-4-cyclopropylquinolin-3-yl}prop-2-enoic acid

ChemComp-FTT:
3-HYDROXY-TETRADECANOIC ACID

ChemComp-MYR:
MYRISTIC ACID

ChemComp-PO4:
PHOSPHATE ION

ChemComp-PA1:
2-amino-2-deoxy-alpha-D-glucopyranose

ChemComp-DAO:
LAURIC ACID

ChemComp-DPO:
DIPHOSPHATE

ChemComp-E1M:
(2E)-3-{6-[(1S)-1-(3-amino-2,6-dichlorophenyl)ethoxy]-4-cyclopropylquinolin-3-yl}prop-2-enoic acid

Source
  • escherichia coli o6:h1 (strain cft073 / atcc 700928 / upec) (bacteria)
KeywordsLIPID TRANSPORT / ABC transporter / inhibitor / LPS / MsbA

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