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9JP

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O3C9doub1.22Å1.23Å
C8C7sing1.53Å1.53Å
C8N1sing1.46Å1.47Å
C9N1sing1.35Å1.38Å
C9N2sing1.35Å1.37Å
C7O2sing1.43Å1.41Å
N1C12sing1.37Å1.37Å
N2C10sing1.35Å1.36Å
C12C11doub1.35Å1.35Å
O2C2sing1.36Å1.38Å
C10C11sing1.42Å1.45Å
C10O4doub1.22Å1.23Å
C1C2doub1.39Å1.40ÅAromatic
C1C6sing1.38Å1.39ÅAromatic
C2C3sing1.39Å1.41ÅAromatic
C6C5doub1.38Å1.39ÅAromatic
C3O1sing1.36Å1.37Å
C3C4doub1.39Å1.40ÅAromatic
O1C13sing1.36Å1.38Å
C5C4sing1.38Å1.40ÅAromatic
C13C18doub1.40Å1.39ÅAromatic
C13C14sing1.38Å1.40ÅAromatic
C18C17sing1.38Å1.39ÅAromatic
C27N3sing1.46Å1.47Å
C24C14sing1.51Å1.53Å
C14C15doub1.41Å1.43ÅAromatic
C17N3sing1.40Å1.41Å
C17C16doub1.41Å1.43ÅAromatic
N3C25sing1.35Å1.36Å
C15C16sing1.42Å1.43ÅAromatic
C15C19sing1.40Å1.42ÅAromatic
C25O5doub1.21Å1.24Å
C25C26sing1.51Å1.54Å
C16C22sing1.41Å1.42ÅAromatic
C19C20doub1.39Å1.39ÅAromatic
C26F1sing1.40Å1.33Å
C22C21doub1.36Å1.39ÅAromatic
C20C21sing1.41Å1.39ÅAromatic
C20C23sing1.43Å1.46Å
C23N4trip1.14Å1.16Å
C4H1sing1.08Å1.08Å
C1H2sing1.08Å1.08Å
C11H3sing1.08Å1.08Å
C12H4sing1.08Å1.08Å
C18H5sing1.08Å1.08Å
C19H6sing1.08Å1.08Å
C21H7sing1.08Å1.08Å
C22H8sing1.08Å1.08Å
C24H9sing1.09Å1.10Å
C24H10sing1.09Å1.10Å
C24H11sing1.09Å1.10Å
C26H12sing1.09Å1.10Å
C26H13sing1.09Å1.10Å
C27H14sing1.09Å1.10Å
C27H15sing1.09Å1.10Å
C27H16sing1.09Å1.10Å
C5H17sing1.08Å1.08Å
C6H18sing1.08Å1.08Å
C7H19sing1.09Å1.10Å
C7H20sing1.09Å1.10Å
C8H21sing1.09Å1.10Å
C8H22sing1.09Å1.10Å
N2H23sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O3C9N1125.4°119.5°
O3C9N2120.3°119.6°
C7C8N1111.2°109.5°
C8C7O2106.7°109.4°
C8C7H19110.2°109.5°
C8C7H20110.1°109.5°
C7C8H21109.0°109.4°
C7C8H22109.1°109.5°
C8N1C9117.2°119.7°
C8N1C12122.7°119.7°
N1C8H21109.0°109.5°
N1C8H22109.0°109.5°
N1C9N2114.2°120.9°
C9N1C12120.1°120.6°
C9N2C10129.7°120.3°
C9N2H23115.2°119.8°
C7O2C2123.0°117.0°
O2C7H19110.1°109.5°
O2C7H20110.2°109.5°
N1C12C11124.1°119.7°
N1C12H4118.0°120.1°
N2C10C11113.0°119.4°
N2C10O4123.1°120.3°
C10N2H23115.2°119.9°
C12C11C10118.9°119.1°
C12C11H3120.5°120.4°
C11C12H4117.9°120.2°
O2C2C1116.8°120.1°
O2C2C3123.7°120.1°
C11C10O4123.8°120.3°
C10C11H3120.6°120.5°
C2C1C6120.4°120.0°
C1C2C3119.5°119.8°
C2C1H2119.8°120.0°
C1C6C5120.1°120.2°
C6C1H2119.8°120.0°
C1C6H18119.9°119.9°
C2C3O1118.4°120.1°
C2C3C4120.1°119.9°
C6C5C4120.2°120.1°
C6C5H17119.9°120.0°
C5C6H18120.0°119.9°
O1C3C4121.5°120.1°
C3O1C13125.8°118.0°
C3C4C5119.9°120.0°
C3C4H1120.1°120.0°
O1C13C18122.8°119.6°
O1C13C14117.0°119.6°
C5C4H1120.1°120.0°
C4C5H17119.9°119.9°
C18C13C14120.2°120.8°
C13C18C17121.2°120.7°
C13C18H5119.4°119.7°
C13C14C24120.1°120.1°
C13C14C15120.6°119.8°
C18C17N3117.6°120.2°
C18C17C16120.0°119.7°
C17C18H5119.4°119.6°
C27N3C17115.5°120.0°
C27N3C25122.8°120.0°
N3C27H14109.5°109.5°
N3C27H15109.4°109.5°
N3C27H16109.4°109.5°
C24C14C15119.3°120.1°
C14C24H9109.5°109.4°
C14C24H10109.5°109.4°
C14C24H11109.4°109.5°
C14C15C16119.1°119.6°
C14C15C19121.8°120.9°
N3C17C16122.5°120.1°
C17N3C25121.6°120.0°
C17C16C15118.9°119.4°
C17C16C22123.0°120.9°
N3C25O5122.3°120.0°
N3C25C26119.3°120.0°
C16C15C19119.1°119.5°
C15C16C22118.1°119.7°
C15C19C20121.1°119.4°
C15C19H6119.4°120.3°
O5C25C26118.3°120.0°
C25C26F1110.7°109.5°
C25C26H12109.2°109.5°
C25C26H13109.2°109.5°
C16C22C21121.0°120.1°
C16C22H8119.5°120.0°
C19C20C21119.8°120.5°
C19C20C23120.0°119.8°
C20C19H6119.5°120.3°
F1C26H12109.2°109.5°
F1C26H13109.2°109.5°
C22C21C20120.9°120.8°
C22C21H7119.5°119.6°
C21C22H8119.5°119.9°
C21C20C23120.2°119.7°
C20C21H7119.5°119.6°
C20C23N4179.9°180.0°
H9C24H10109.5°109.5°
H9C24H11109.5°109.5°
H10C24H11109.5°109.5°
H12C26H13109.5°109.4°
H14C27H15109.4°109.5°
H14C27H16109.5°109.4°
H15C27H16109.5°109.5°
H19C7H20109.5°109.5°
H21C8H22109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O3C9N1C80.3°0.3°
O3C9N1N2179.8°179.9°
O3C9N1C12179.9°180.0°
O3C9N2C10180.0°180.0°
O3C9N2H230.1°0.1°
C7C8N1H21120.3°120.0°
C7C8N1H22120.3°120.0°
C7C8N1C984.7°89.7°
C8C7O2H19119.6°120.0°
C8C7O2H20119.5°120.0°
C7C8N1C1294.9°90.0°
C8C7O2C2152.9°180.0°
C8C7H19H20121.3°120.0°
C7C8H21H22119.2°120.0°
C8N1C9C12179.6°179.7°
C8N1C9N2179.9°179.8°
N1C8C7O263.7°65.0°
C8N1C12C11179.8°179.9°
C8N1C12H40.2°0.0°
N1C8C7H1955.9°175.0°
N1C8C7H20176.7°55.0°
N1C8H21H22119.2°120.0°
N1C9N2C100.2°0.1°
C9N1C12C110.2°0.3°
C9N1C12H4179.8°179.7°
C9N1C8H21155.0°30.3°
C9N1C8H2235.6°150.3°
N1C9N2H23179.9°180.0°
N2C9N1C120.3°0.1°
C9N2C10H23180.0°179.9°
C9N2C10C110.0°0.3°
C9N2C10O4180.0°179.8°
C7O2C2C121.8°0.0°
C7O2C2C3158.7°179.8°
O2C7H19H20121.3°120.0°
O2C7C8H2156.6°55.0°
O2C7C8H22176.0°175.0°
N1C12C11H4180.0°180.0°
N1C12C11C100.0°0.5°
N1C12C11H3180.0°179.5°
C12N1C8H2125.3°150.0°
C12N1C8H22144.8°30.0°
N2C10C11C120.1°0.5°
N2C10C11O4180.0°179.5°
N2C10C11H3179.9°179.5°
C12C11C10H3180.0°180.0°
C12C11C10O4179.9°180.0°
O2C2C1C3179.5°179.8°
O2C2C1C6179.9°180.0°
O2C2C3O10.9°0.2°
O2C2C3C4179.9°179.8°
O2C2C1H20.1°0.2°
C2O2C7H1933.4°60.0°
C2O2C7H2087.5°60.0°
C10C11C12H4180.0°179.5°
C11C10N2H23179.9°179.8°
O4C10C11H30.1°0.0°
O4C10N2H230.1°0.3°
C2C1C6H2180.0°179.8°
C2C1C6C50.1°0.3°
C1C2C3O1179.6°180.0°
C1C2C3C40.6°0.0°
C2C1C6H18179.9°180.0°
C6C1C2C30.4°0.3°
C1C6C5H18180.0°179.7°
C1C6C5C40.0°0.0°
C1C6C5H17179.9°180.0°
C2C3O1C4179.0°179.9°
C2C3O1C13145.2°85.9°
C2C3C4C50.6°0.3°
C2C3C4H1179.5°180.0°
C3C2C1H2179.6°180.0°
C6C5C4C30.3°0.2°
C6C5C4H17180.0°180.0°
C6C5C4H1179.8°180.0°
C5C6C1H2179.9°180.0°
O1C3C4C5179.5°179.8°
C3O1C13C1853.4°2.3°
C3O1C13C14128.0°177.9°
O1C3C4H10.5°0.1°
C4C3O1C1335.8°94.0°
C3C4C5H1180.0°179.7°
C3C4C5H17179.7°179.7°
O1C13C18C14178.6°179.8°
O1C13C18C17179.6°179.7°
O1C13C14C240.9°0.3°
O1C13C14C15179.5°179.8°
O1C13C18H50.5°0.2°
C4C5C6H18180.0°179.7°
C13C18C17H5180.0°179.9°
C18C13C14C24179.6°180.0°
C18C13C14C150.8°0.0°
C13C18C17N3179.9°180.0°
C13C18C17C160.8°0.0°
C14C13C18C171.0°0.0°
C13C14C24C15179.6°180.0°
C13C14C15C160.4°0.0°
C13C14C15C19179.7°180.0°
C14C13C18H5179.0°180.0°
C13C14C24H989.8°90.0°
C13C14C24H10150.2°150.0°
C13C14C24H1130.2°30.0°
C18C17N3C2791.9°89.9°
C18C17N3C16179.4°180.0°
C18C17N3C2587.9°90.1°
C18C17C16C150.3°0.0°
C18C17C16C22179.9°180.0°
C27N3C17C25179.9°180.0°
C27N3C17C1687.5°90.0°
C27N3C25O50.1°180.0°
C27N3C25C26180.0°0.0°
N3C27H14H15120.0°120.0°
N3C27H14H16120.0°120.0°
N3C27H15H16120.0°120.0°
C24C14C15C16180.0°180.0°
C24C14C15C190.1°0.0°
C14C24H9H10120.0°120.0°
C14C24H9H11120.0°120.0°
C14C24H10H11120.0°120.0°
C14C15C16C170.2°0.0°
C14C15C16C19179.9°180.0°
C14C15C16C22180.0°180.0°
C14C15C19C20179.9°180.0°
C14C15C19H60.1°0.0°
C15C14C24H989.8°90.1°
C15C14C24H1030.2°29.9°
C15C14C24H11150.2°150.0°
N3C17C16C15179.7°180.0°
C17N3C25O5180.0°0.0°
C17N3C25C260.1°180.0°
N3C17C16C220.5°0.0°
N3C17C18H50.1°0.1°
C17N3C27H14180.0°90.0°
C17N3C27H1560.0°150.0°
C17N3C27H1660.0°29.9°
C16C17N3C2592.7°90.0°
C17C16C15C22179.8°180.0°
C17C16C15C19180.0°180.0°
C17C16C22C21179.8°180.0°
C16C17C18H5179.3°180.0°
C17C16C22H80.2°0.0°
N3C25O5C26179.9°180.0°
N3C25C26F1165.8°180.0°
N3C25C26H1245.6°60.0°
N3C25C26H1374.1°60.0°
C25N3C27H140.1°90.0°
C25N3C27H15119.8°30.0°
C25N3C27H16120.2°150.1°
C16C15C19C200.2°0.1°
C15C16C22C210.0°0.0°
C16C15C19H6179.8°180.0°
C15C16C22H8180.0°180.0°
C19C15C16C220.1°0.0°
C15C19C20H6180.0°179.9°
C15C19C20C210.1°0.1°
C15C19C20C23179.9°180.0°
O5C25C26F114.1°0.0°
O5C25C26H12134.3°120.1°
O5C25C26H13106.0°120.0°
C25C26F1H12120.2°120.0°
C25C26F1H13120.2°120.0°
C25C26H12H13119.4°120.0°
C16C22C21H8180.0°180.0°
C16C22C21C200.1°0.0°
C16C22C21H7179.9°180.0°
C19C20C21C220.1°0.0°
C19C20C21C23180.0°179.9°
C19C20C23N422.3°122.9°
C19C20C21H7179.9°179.9°
F1C26H12H13119.4°120.0°
C22C21C20H7180.0°180.0°
C22C21C20C23179.9°180.0°
C21C20C23N4157.7°57.0°
C21C20C19H6180.0°180.0°
C20C21C22H8179.8°180.0°
C23C20C19H60.1°0.1°
C23C20C21H70.1°0.0°
H1C4C5H170.3°0.0°
H2C1C6H180.1°0.3°
H3C11C12H40.0°0.5°
H7C21C22H80.1°0.0°
H9C24H10H11120.0°120.0°
H14C27H15H16120.0°120.0°
H17C5C6H180.0°0.3°
H19C7C8H21176.1°65.0°
H19C7C8H2264.4°55.0°
H20C7C8H2163.0°175.0°
H20C7C8H2256.5°65.0°

223166

PDB entries from 2024-07-31

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