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Structure paper

TitleGBT440 increases haemoglobin oxygen affinity, reduces sickling and prolongs RBC half-life in a murine model of sickle cell disease.
Journal, issue, pagesBr. J. Haematol., Vol. 175, Page 141-153, Year 2016
Publish dateOct 13, 2015 (structure data deposition date)
AuthorsOksenberg, D. / Dufu, K. / Patel, M.P. / Chuang, C. / Li, Z. / Xu, Q. / Silva-Garcia, A. / Zhou, C. / Hutchaleelaha, A. / Patskovska, L. ...Oksenberg, D. / Dufu, K. / Patel, M.P. / Chuang, C. / Li, Z. / Xu, Q. / Silva-Garcia, A. / Zhou, C. / Hutchaleelaha, A. / Patskovska, L. / Patskovsky, Y. / Almo, S.C. / Sinha, U. / Metcalf, B.W. / Archer, D.R.
External linksBr. J. Haematol. / PubMed:27378309
MethodsX-ray diffraction
Resolution1.8 Å
Structure data

PDB-5e83:
CRYSTAL STRUCTURE OF CARBONMONOXY HEMOGLOBIN S (LIGANDED SICKLE CELL HEMOGLOBIN) COMPLEXED WITH GBT440, CO-CRYSTALLIZATION EXPERIMENT
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-CMO:
CARBON MONOXIDE

ChemComp-5L7:
2-methyl-3-({2-[1-(propan-2-yl)-1H-pyrazol-5-yl]pyridin-3-yl}methoxy)phenol

ChemComp-GOL:
GLYCEROL


ChemComp, No image

ChemComp-UNL:
Unknown ligand

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsOXYGEN TRANSPORT / MUTANT HUMAN HEMOGLOBIN S[BETAE6V] / R2 QUATERNARY STATE

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