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5U3I

CRYSTAL STRUCTURE OF CARBONMONOXY HEMOGLOBIN S (LIGANDED SICKLE CELL HEMOGLOBIN) COMPLEXED WITH GBT compound 31

Summary for 5U3I
Entry DOI10.2210/pdb5u3i/pdb
Related5UFJ
DescriptorHemoglobin subunit alpha, Hemoglobin subunit beta, PROTOPORPHYRIN IX CONTAINING FE, ... (6 entities in total)
Functional Keywordsr2 quaternary state, oxygen transport
Biological sourceHomo sapiens (Human)
More
Total number of polymer chains4
Total formula weight64951.51
Authors
Partridge, J.R.,Choy, R.M.,Li, Z.,Metcalf, B. (deposition date: 2016-12-02, release date: 2017-02-22, Last modification date: 2023-10-04)
Primary citationMetcalf, B.,Chuang, C.,Dufu, K.,Patel, M.P.,Silva-Garcia, A.,Johnson, C.,Lu, Q.,Partridge, J.R.,Patskovska, L.,Patskovsky, Y.,Almo, S.C.,Jacobson, M.P.,Hua, L.,Xu, Q.,Gwaltney, S.L.,Yee, C.,Harris, J.,Morgan, B.P.,James, J.,Xu, D.,Hutchaleelaha, A.,Paulvannan, K.,Oksenberg, D.,Li, Z.
Discovery of GBT440, an Orally Bioavailable R-State Stabilizer of Sickle Cell Hemoglobin.
ACS Med Chem Lett, 8:321-326, 2017
Cited by
PubMed: 28337324
DOI: 10.1021/acsmedchemlett.6b00491
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.95 Å)
Structure validation

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