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0OF

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O32C28sing1.36Å1.37Å
C28C29doub1.38Å1.38ÅAromatic
C28C27sing1.39Å1.39ÅAromatic
C29C30sing1.39Å1.40ÅAromatic
C34N35doub1.32Å1.36ÅAromatic
C34C33sing1.39Å1.40ÅAromatic
N35C36sing1.32Å1.35ÅAromatic
C27C26doub1.38Å1.41ÅAromatic
C30C33sing1.48Å1.47Å
C30C31doub1.39Å1.41ÅAromatic
C33C38doub1.40Å1.40ÅAromatic
C36C37doub1.38Å1.38ÅAromatic
C26C31sing1.38Å1.41ÅAromatic
C26C1sing1.51Å1.52Å
C38C37sing1.38Å1.40ÅAromatic
C1C2sing1.51Å1.52Å
C1C7sing1.51Å1.51Å
O8C2doub1.21Å1.23Å
C2N3sing1.33Å1.39Å
F23C20sing1.40Å1.36Å
C7O9doub1.21Å1.23Å
C7N6sing1.33Å1.40Å
N3C4sing1.39Å1.42Å
N3C24sing1.46Å1.48Å
C13C4doub1.40Å1.42ÅAromatic
C13C12sing1.38Å1.40ÅAromatic
C4C5sing1.39Å1.40ÅAromatic
C12C11doub1.38Å1.39ÅAromatic
C24C25sing1.53Å1.53Å
C5N6sing1.39Å1.44Å
C5C10doub1.40Å1.41ÅAromatic
C11C10sing1.38Å1.39ÅAromatic
C11C20sing1.51Å1.49Å
N6C14sing1.40Å1.44Å
C20F21sing1.40Å1.36Å
C20F22sing1.40Å1.36Å
C19C14doub1.39Å1.40ÅAromatic
C19C18sing1.38Å1.39ÅAromatic
C14C15sing1.39Å1.41ÅAromatic
C18C17doub1.38Å1.39ÅAromatic
C15C16doub1.38Å1.39ÅAromatic
C17C16sing1.38Å1.39ÅAromatic
C1H1sing1.09Å1.10Å
C10H2sing1.08Å1.08Å
C12H3sing1.08Å1.08Å
C13H4sing1.08Å1.08Å
C15H5sing1.08Å1.08Å
C16H6sing1.08Å1.08Å
C17H7sing1.08Å1.08Å
C18H8sing1.08Å1.08Å
C19H9sing1.08Å1.08Å
C24H10sing1.09Å1.10Å
C24H11sing1.09Å1.10Å
C25H12sing1.09Å1.10Å
C25H13sing1.09Å1.10Å
C25H14sing1.09Å1.10Å
C27H15sing1.08Å1.08Å
C29H16sing1.08Å1.08Å
C31H17sing1.08Å1.08Å
O32H18sing0.97Å0.95Å
C34H19sing1.08Å1.08Å
C36H20sing1.08Å1.08Å
C37H21sing1.08Å1.08Å
C38H22sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O32C28C29120.1°120.0°
O32C28C27118.8°120.0°
C28O32H18109.5°114.0°
C29C28C27121.1°120.0°
C28C29C30121.4°119.8°
C28C29H16119.3°120.1°
C28C27C26119.2°120.2°
C28C27H15120.4°119.9°
C29C30C33118.8°120.1°
C29C30C31117.7°119.8°
C30C29H16119.3°120.1°
N35C34C33124.8°120.6°
C34N35C36116.3°121.9°
N35C34H19117.6°119.7°
C34C33C30120.6°120.5°
C34C33C38116.2°118.9°
C33C34H19117.6°119.7°
N35C36C37124.0°121.0°
N35C36H20118.0°119.5°
C27C26C31119.3°120.1°
C27C26C1120.0°119.9°
C26C27H15120.4°119.9°
C33C30C31123.5°120.1°
C30C33C38123.3°120.6°
C30C31C26121.4°120.0°
C30C31H17119.3°120.0°
C33C38C37120.3°118.3°
C33C38H22119.8°120.9°
C36C37C38118.3°119.3°
C37C36H20118.0°119.5°
C36C37H21120.8°120.3°
C31C26C1120.7°120.0°
C26C31H17119.3°120.0°
C26C1C2112.3°109.7°
C26C1C7114.4°109.7°
C26C1H1108.1°109.7°
C38C37H21120.9°120.3°
C37C38H22119.8°120.8°
C2C1C7105.5°108.3°
C1C2O8123.2°119.4°
C1C2N3116.1°121.2°
C2C1H1108.1°109.7°
C1C7O9122.1°119.4°
C1C7N6114.7°121.2°
C7C1H1108.3°109.6°
O8C2N3120.6°119.4°
C2N3C4123.1°125.6°
C2N3C24118.3°117.1°
F23C20C11111.7°109.4°
F23C20F21106.7°109.5°
F23C20F22105.6°109.5°
O9C7N6123.2°119.4°
C7N6C5123.0°125.6°
C7N6C14119.0°117.2°
C4N3C24118.5°117.2°
N3C4C13120.0°116.8°
N3C4C5120.1°123.8°
N3C24C25112.2°109.5°
N3C24H10108.8°109.5°
N3C24H11108.8°109.4°
C4C13C12120.2°120.7°
C13C4C5119.8°119.4°
C4C13H4119.9°119.7°
C13C12C11120.2°119.9°
C13C12H3119.9°120.0°
C12C13H4119.9°119.7°
C4C5N6125.8°123.7°
C4C5C10118.7°119.4°
C12C11C10119.9°119.9°
C12C11C20118.9°120.0°
C11C12H3119.9°120.1°
C25C24H10108.8°109.5°
C25C24H11108.8°109.4°
C24C25H12109.5°109.5°
C24C25H13109.4°109.5°
C24C25H14109.5°109.4°
N6C5C10115.3°116.9°
C5N6C14117.8°117.2°
C5C10C11121.2°120.8°
C5C10H2119.4°119.6°
C10C11C20121.2°120.1°
C11C10H2119.4°119.6°
C11C20F21114.5°109.4°
C11C20F22110.3°109.5°
N6C14C19121.6°120.0°
N6C14C15119.8°120.1°
F21C20F22107.6°109.5°
C14C19C18120.4°119.9°
C19C14C15118.6°119.9°
C14C19H9119.8°120.0°
C19C18C17120.5°120.1°
C19C18H8119.8°119.9°
C18C19H9119.8°120.1°
C14C15C16121.0°119.9°
C14C15H5119.5°120.0°
C18C17C16119.9°120.2°
C18C17H7120.0°119.9°
C17C18H8119.7°120.0°
C15C16C17119.6°120.1°
C16C15H5119.5°120.1°
C15C16H6120.2°119.9°
C17C16H6120.2°120.0°
C16C17H7120.0°119.9°
H10C24H11109.4°109.5°
H12C25H13109.5°109.5°
H12C25H14109.5°109.5°
H13C25H14109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O32C28C29C27180.0°180.0°
O32C28C29C30179.9°180.0°
O32C28C27C26180.0°180.0°
O32C28C27H150.0°0.0°
O32C28C29H160.1°0.1°
C28C29C30H16180.0°179.9°
C29C28C27C260.0°0.0°
C28C29C30C33179.5°180.0°
C28C29C30C310.1°0.1°
C29C28C27H15180.0°180.0°
C29C28O32H18180.0°90.0°
C27C28C29C300.1°0.0°
C28C27C26H15180.0°180.0°
C28C27C26C310.3°0.0°
C28C27C26C1179.7°179.7°
C27C28C29H16179.9°179.9°
C27C28O32H180.0°90.0°
C29C30C33C3414.0°179.7°
C29C30C33C31179.4°179.9°
C29C30C33C38165.7°0.0°
C29C30C31C260.4°0.1°
C29C30C31H17179.6°179.7°
N35C34C33H19180.0°179.9°
N35C34C33C30179.6°179.9°
N35C34C33C380.1°0.2°
C34N35C36C370.3°0.0°
C34N35C36H20179.7°180.0°
C33C34N35C360.2°0.1°
C34C33C30C38179.7°179.7°
C34C33C30C31166.6°0.3°
C34C33C38C370.3°0.5°
C34C33C38H22179.6°179.7°
N35C36C37H20180.0°180.0°
N35C36C37C380.1°0.3°
C36N35C34H19179.8°180.0°
N35C36C37H21179.9°180.0°
C27C26C31C300.5°0.0°
C27C26C31C1179.9°179.7°
C27C26C1C2113.3°31.6°
C27C26C1C7126.6°150.5°
C27C26C1H15.9°89.0°
C27C26C31H17179.5°179.7°
C33C30C31C26179.8°180.0°
C30C33C38C37179.4°179.8°
C33C30C29H160.5°0.1°
C33C30C31H170.2°0.2°
C30C33C34H190.4°0.0°
C30C33C38H220.6°0.0°
C31C30C33C3813.6°180.0°
C30C31C26H17180.0°179.8°
C30C31C26C1179.5°179.8°
C31C30C29H16179.9°180.0°
C33C38C37C360.2°0.5°
C33C38C37H22180.0°179.8°
C38C33C34H19179.9°179.7°
C33C38C37H21179.8°179.7°
C36C37C38H21180.0°179.7°
C36C37C38H22179.7°179.7°
C31C26C1C266.7°148.6°
C31C26C1C753.4°29.8°
C31C26C1H1174.1°90.7°
C31C26C27H15179.7°180.0°
C26C1C2C7125.2°119.7°
C26C1C2H1119.2°120.6°
C26C1C7H1120.6°120.6°
C26C1C2O822.3°122.3°
C26C1C2N3156.2°57.8°
C26C1C7O915.4°122.2°
C26C1C7N6166.0°57.8°
C1C26C27H150.3°0.3°
C1C26C31H170.5°0.0°
C38C37C36H20179.9°179.7°
C2C1C7H1115.5°119.7°
C1C2O8N3178.5°180.0°
C2C1C7O9108.5°118.1°
C2C1C7N670.1°61.9°
C1C2N3C42.8°2.1°
C1C2N3C24179.8°177.8°
C7C1C2O8102.8°118.0°
C7C1C2N378.6°62.0°
C1C7O9N6178.5°180.0°
C1C7N6C54.7°2.1°
C1C7N6C14179.8°177.8°
O8C2N3C4178.7°177.9°
O8C2N3C241.3°2.2°
O8C2C1H1141.5°1.6°
C2N3C4C24177.4°179.9°
C2N3C4C13138.0°138.8°
C2N3C4C546.4°41.3°
C2N3C24C25116.1°84.9°
N3C2C1H137.0°178.4°
C2N3C24H10123.5°35.1°
C2N3C24H114.4°155.1°
F23C20C11C1270.0°150.0°
F23C20C11C10109.3°29.9°
F23C20C11F21121.4°119.9°
F23C20C11F22117.1°120.0°
F23C20F21F22112.9°120.0°
O9C7N6C5176.7°177.9°
O9C7N6C141.2°2.3°
O9C7C1H1136.0°1.6°
C7N6C5C444.1°41.2°
C7N6C5C14175.5°179.9°
C7N6C5C10130.8°138.8°
C7N6C14C1965.4°83.3°
C7N6C14C15114.0°97.0°
N6C7C1H145.4°178.4°
N3C4C13C5175.6°180.0°
N3C4C13C12178.4°179.9°
C4N3C24C2561.4°95.0°
N3C4C5N65.7°0.1°
N3C4C5C10179.6°180.0°
N3C4C13H41.6°0.0°
C4N3C24H1059.0°144.9°
C4N3C24H11178.1°24.9°
C24N3C4C1344.6°41.3°
C24N3C4C5131.0°138.7°
N3C24C25H10120.4°120.0°
N3C24C25H11120.4°120.0°
N3C24H10H11118.7°120.0°
N3C24C25H12180.0°175.2°
N3C24C25H1360.0°64.8°
N3C24C25H1460.0°55.2°
C4C13C12H4180.0°180.0°
C4C13C12C111.1°0.0°
C13C4C5N6178.7°180.0°
C13C4C5C103.9°0.0°
C4C13C12H3178.9°180.0°
C12C13C4C52.8°0.0°
C13C12C11H3180.0°180.0°
C13C12C11C100.5°0.0°
C13C12C11C20179.8°180.0°
C4C5N6C10174.9°180.0°
C4C5C10C113.5°0.0°
C4C5N6C14140.4°138.7°
C4C5C10H2176.5°179.9°
C5C4C13H4177.2°180.0°
C12C11C10C51.7°0.0°
C12C11C10C20179.3°180.0°
C12C11C20F21168.7°90.0°
C12C11C20F2247.2°30.0°
C12C11C10H2178.2°179.9°
C11C12C13H4178.9°180.0°
C25C24H10H11118.8°120.0°
C24C25H12H13120.0°120.1°
C24C25H12H14120.0°120.0°
C24C25H13H14120.0°119.9°
N6C5C10C11178.7°180.0°
C5N6C14C19110.3°96.8°
C5N6C14C1570.3°82.9°
N6C5C10H21.2°0.0°
C5C10C11H2180.0°180.0°
C5C10C11C20179.0°180.0°
C10C5N6C1444.7°41.3°
C10C11C20F2112.0°90.0°
C10C11C20F22133.6°150.0°
C10C11C12H3179.5°180.0°
C11C20F21F22123.0°120.0°
C20C11C10H21.0°0.0°
C20C11C12H30.2°0.0°
N6C14C19C15179.4°179.7°
N6C14C19C18179.5°179.7°
N6C14C15C16179.9°180.0°
N6C14C15H50.1°0.0°
N6C14C19H90.6°0.0°
C14C19C18H9180.0°179.7°
C14C19C18C170.4°0.5°
C19C14C15C160.4°0.3°
C19C14C15H5179.5°179.8°
C14C19C18H8179.6°179.7°
C18C19C14C150.0°0.5°
C19C18C17H8180.0°179.8°
C19C18C17C160.5°0.3°
C19C18C17H7179.5°179.8°
C14C15C16H5180.0°180.0°
C14C15C16C170.4°0.0°
C14C15C16H6179.6°180.0°
C15C14C19H9180.0°179.8°
C18C17C16C150.1°0.0°
C18C17C16H7180.0°180.0°
C18C17C16H6179.9°180.0°
C17C18C19H9179.6°179.8°
C15C16C17H6180.0°180.0°
C15C16C17H7179.9°180.0°
C17C16C15H5179.6°180.0°
C16C17C18H8179.5°180.0°
H3C12C13H41.1°0.0°
H5C15C16H60.4°0.1°
H6C16C17H70.1°0.1°
H7C17C18H80.5°0.0°
H8C18C19H90.4°0.0°
H10C24C25H1259.6°55.2°
H10C24C25H13179.6°175.2°
H10C24C25H1460.4°64.9°
H11C24C25H1259.6°64.9°
H11C24C25H1360.4°55.2°
H11C24C25H14179.6°175.1°
H12C25H13H14120.0°120.0°
H20C36C37H210.1°0.0°
H21C37C38H220.3°0.0°

224201

PDB entries from 2024-08-28

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