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TitleMapping the Binding Trajectory of a Suicide Inhibitor in Human Indoleamine 2,3-Dioxygenase 1.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 140, Page 14538-14541, Year 2018
Publish dateJun 9, 2018 (structure data deposition date)
AuthorsPham, K.N. / Yeh, S.R.
External linksJ. Am. Chem. Soc. / PubMed:30347977
MethodsX-ray diffraction
Resolution2.94 - 3.2 Å
Structure data

PDB-6dpq:
Mapping the binding trajectory of a suicide inhibitor in human indoleamine 2,3-dioxygenase 1
Method: X-RAY DIFFRACTION / Resolution: 2.94 Å

PDB-6dpr:
Mapping the binding trajectory of a suicide inhibitor in human indoleamine 2,3-dioxygenase 1
Method: X-RAY DIFFRACTION / Resolution: 3.2 Å

PDB-6mq6:
Mapping the binding trajectory of a suicide inhibitor in human indoleamine 2,3-dioxygenase 1
Method: X-RAY DIFFRACTION / Resolution: 3.05 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-GOL:
GLYCEROL

ChemComp-H7P:
(2R)-N-(4-chlorophenyl)-2-[cis-4-(6-fluoroquinolin-4-yl)cyclohexyl]propanamide

ChemComp-HOH:
WATER

ChemComp-EDO:
1,2-ETHANEDIOL

Source
  • homo sapiens (human)
KeywordsOXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR / indoleamine 2 / 3-dioxygenase / heme-containing enzyme / BMS-986205 / structure-based design / hIDO1-selective inhibitor / OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex / OXYGEN BINDING

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