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30J

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C15C18sing1.51Å1.53Å
C15C9sing1.51Å1.52Å
C18C19doub1.38Å1.38ÅAromatic
C18C27sing1.38Å1.39ÅAromatic
C19C21sing1.38Å1.38ÅAromatic
C27C25doub1.38Å1.38ÅAromatic
C21C23doub1.38Å1.39ÅAromatic
N8C9doub1.31Å1.31ÅAromatic
N8N7sing1.28Å1.31ÅAromatic
C23C25sing1.38Å1.38ÅAromatic
C9C10sing1.41Å1.37ÅAromatic
N7C6doub1.32Å1.32ÅAromatic
C10C11doub1.40Å1.38ÅAromatic
C10C5sing1.42Å1.39ÅAromatic
C6C5sing1.41Å1.38ÅAromatic
C6N29sing1.39Å1.33Å
C39N29sing1.47Å1.43Å
C39C36sing1.53Å1.52Å
C11C13sing1.36Å1.36ÅAromatic
C5C3doub1.40Å1.37ÅAromatic
N29C30sing1.47Å1.45Å
C36N35sing1.47Å1.44Å
C13C2doub1.39Å1.37ÅAromatic
N43C44doub1.32Å1.33ÅAromatic
N43C42sing1.33Å1.32ÅAromatic
C3C2sing1.37Å1.38ÅAromatic
C44C46sing1.40Å1.38ÅAromatic
C30C33sing1.53Å1.53Å
N35C42sing1.39Å1.33Å
N35C33sing1.47Å1.43Å
C2CL1sing1.74Å1.71Å
C42C49doub1.39Å1.38ÅAromatic
C33C53sing1.53Å1.54Å
C46C51sing1.43Å1.42Å
C46C47doub1.40Å1.38ÅAromatic
C51N52trip1.14Å1.14Å
C49C47sing1.37Å1.38ÅAromatic
C3H1sing1.08Å1.08Å
C44H2sing1.08Å1.08Å
C47H3sing1.08Å1.08Å
C49H4sing1.08Å1.08Å
C53H5sing1.09Å1.10Å
C53H6sing1.09Å1.10Å
C53H7sing1.09Å1.10Å
C11H8sing1.08Å1.08Å
C13H9sing1.08Å1.08Å
C15H10sing1.09Å1.10Å
C15H11sing1.09Å1.10Å
C19H12sing1.08Å1.08Å
C21H13sing1.08Å1.08Å
C23H14sing1.08Å1.08Å
C25H15sing1.08Å1.08Å
C27H16sing1.08Å1.08Å
C30H17sing1.09Å1.10Å
C30H18sing1.09Å1.10Å
C33H19sing1.09Å1.10Å
C36H20sing1.09Å1.10Å
C36H21sing1.09Å1.10Å
C39H22sing1.09Å1.10Å
C39H23sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C18C15C9106.0°109.5°
C15C18C19120.8°120.0°
C15C18C27120.5°120.0°
C18C15H10110.3°109.5°
C18C15H11110.3°109.4°
C15C9N8118.2°120.5°
C15C9C10122.6°120.5°
C9C15H10110.4°109.5°
C9C15H11110.3°109.4°
C19C18C27118.6°120.0°
C18C19C21120.5°120.0°
C18C19H12119.8°120.0°
C18C27C25121.4°120.0°
C18C27H16119.3°120.0°
C19C21C23120.3°120.0°
C21C19H12119.7°119.9°
C19C21H13119.9°120.0°
C27C25C23119.4°120.0°
C27C25H15120.3°120.0°
C25C27H16119.3°120.0°
C21C23C25119.7°120.0°
C23C21H13119.9°120.0°
C21C23H14120.1°120.0°
C9N8N7122.8°123.6°
N8C9C10119.1°119.1°
N8N7C6121.5°123.2°
C25C23H14120.1°120.0°
C23C25H15120.3°120.0°
C9C10C11119.1°122.7°
C9C10C5119.1°117.7°
N7C6C5119.2°118.8°
N7C6N29116.5°120.6°
C11C10C5121.8°119.5°
C10C11C13118.5°119.4°
C10C11H8120.7°120.3°
C10C5C6118.2°117.6°
C10C5C3119.4°119.6°
C5C6N29124.1°120.6°
C6C5C3122.4°122.8°
C6N29C39119.6°111.0°
C6N29C30115.3°111.0°
N29C39C36110.5°109.4°
C39N29C30124.8°110.9°
N29C39H22109.2°109.5°
N29C39H23109.2°109.5°
C39C36N35110.5°109.4°
C39C36H20109.2°109.5°
C39C36H21109.2°109.5°
C36C39H22109.2°109.5°
C36C39H23109.2°109.5°
C11C13C2119.9°121.0°
C13C11H8120.7°120.3°
C11C13H9120.1°119.5°
C5C3C2118.1°119.4°
C5C3H1120.9°120.3°
N29C30C33118.2°109.4°
N29C30H17107.3°109.5°
N29C30H18107.3°109.5°
C36N35C42119.9°111.0°
C36N35C33120.2°110.9°
N35C36H20109.2°109.5°
N35C36H21109.2°109.5°
C13C2C3122.2°121.1°
C13C2CL1116.8°119.5°
C2C13H9120.1°119.5°
C44N43C42121.7°121.7°
N43C44C46120.0°120.5°
N43C44H2120.0°119.7°
N43C42N35118.4°119.5°
N43C42C49120.2°120.9°
C3C2CL1120.9°119.5°
C2C3H1120.9°120.4°
C44C46C51119.3°120.4°
C44C46C47120.0°119.1°
C46C44H2120.0°119.8°
C30C33N35111.1°109.4°
C30C33C53110.3°109.5°
C33C30H17107.2°109.5°
C33C30H18107.3°109.5°
C30C33H19108.9°109.5°
C42N35C33119.8°111.0°
N35C42C49121.4°119.6°
N35C33C53107.5°109.5°
N35C33H19110.2°109.5°
C42C49C47120.0°119.4°
C42C49H4120.0°120.3°
C33C53H5109.5°109.5°
C33C53H6109.5°109.5°
C33C53H7109.4°109.5°
C53C33H19108.9°109.4°
C51C46C47120.7°120.5°
C46C51N52177.9°180.0°
C46C47C49118.1°118.5°
C46C47H3121.0°120.8°
C49C47H3120.9°120.7°
C47C49H4120.0°120.3°
H5C53H6109.5°109.4°
H5C53H7109.5°109.5°
H6C53H7109.4°109.5°
H10C15H11109.5°109.5°
H17C30H18109.5°109.5°
H20C36H21109.5°109.5°
H22C39H23109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C18C15C9H10119.4°120.1°
C18C15C9H11119.4°120.0°
C15C18C19C27178.7°179.8°
C15C18C19C21179.3°180.0°
C15C18C27C25179.4°179.8°
C18C15C9N889.1°90.0°
C18C15C9C1088.7°90.0°
C18C15H10H11121.6°120.0°
C15C18C19H120.7°0.0°
C15C18C27H160.7°0.0°
C9C15C18C19140.2°89.9°
C9C15C18C2738.5°90.3°
C15C9N8C10178.0°179.9°
C15C9N8N7179.1°180.0°
C15C9C10C111.0°0.2°
C15C9C10C5178.5°179.9°
C9C15H10H11121.6°120.0°
C18C19C21H12180.0°180.0°
C19C18C27C250.7°0.4°
C18C19C21C230.0°0.0°
C19C18C15H1020.7°150.0°
C19C18C15H11100.4°30.0°
C18C19C21H13180.0°180.0°
C19C18C27H16179.4°179.8°
C27C18C19C210.6°0.2°
C18C27C25H16180.0°179.8°
C18C27C25C230.0°0.4°
C27C18C15H10158.0°29.8°
C27C18C15H1180.9°149.8°
C27C18C19H12179.4°179.8°
C18C27C25H15180.0°179.7°
C19C21C23H13180.0°180.0°
C19C21C23C250.7°0.0°
C19C21C23H14179.3°179.9°
C27C25C23C210.7°0.2°
C27C25C23H15180.0°179.9°
C27C25C23H14179.3°179.9°
C21C23C25H14180.0°179.9°
C23C21C19H12180.0°180.0°
C21C23C25H15179.3°180.0°
C9N8N7C60.2°0.0°
N8C9C10C11178.9°179.7°
N8C9C10C50.6°0.0°
N8C9C15H10151.4°30.1°
N8C9C15H1130.3°150.0°
N7N8C9C101.1°0.0°
N8N7C6C51.1°0.0°
N8N7C6N29177.2°180.0°
C25C23C21H13179.3°180.0°
C23C25C27H16180.0°179.8°
C9C10C11C5179.5°179.7°
C9C10C5C60.7°0.1°
C9C10C11C13179.8°180.0°
C9C10C5C3179.7°180.0°
C9C10C11H80.2°0.0°
C10C9C15H1030.7°150.0°
C10C9C15H11151.8°30.0°
N7C6C5C101.5°0.1°
N7C6C5N29175.8°180.0°
N7C6N29C3938.4°62.1°
N7C6C5C3178.9°180.0°
N7C6N29C30135.7°61.7°
C11C10C5C6179.8°179.8°
C10C11C13H8180.0°180.0°
C11C10C5C30.3°0.3°
C10C11C13C20.8°0.0°
C10C11C13H9179.2°180.0°
C10C5C6C3179.6°179.9°
C10C5C6N29177.3°180.0°
C5C10C11C130.7°0.3°
C10C5C3C20.1°0.0°
C10C5C3H1179.9°179.9°
C5C10C11H8179.3°179.7°
C5C6N29C39145.7°117.9°
C5C6N29C3040.2°118.3°
C6C5C3C2179.5°179.9°
C6C5C3H10.5°0.0°
C6N29C39C30173.5°123.9°
C6N29C39C36159.8°176.8°
N29C6C5C33.1°0.0°
C6N29C30C33175.9°176.8°
C6N29C30H1762.9°63.2°
C6N29C30H1854.6°56.8°
C6N29C39H2239.6°56.9°
C6N29C39H2380.0°63.2°
N29C39C36H22120.2°120.0°
N29C39C36H23120.2°120.0°
N29C39C36N3546.8°58.4°
C39N29C30C3310.3°59.3°
C39N29C30H17110.9°60.7°
C39N29C30H18131.6°179.3°
N29C39C36H2073.4°178.4°
N29C39C36H21166.9°61.6°
N29C39H22H23119.5°120.0°
C36C39N29C3026.7°59.3°
C39C36N35H20120.2°120.0°
C39C36N35H21120.2°120.0°
C39C36N35C42123.3°176.8°
C39C36N35C3358.3°59.3°
C39C36H20H21119.5°120.1°
C36C39H22H23119.5°120.1°
C11C13C2H9180.0°180.0°
C11C13C2C30.5°0.3°
C11C13C2CL1179.3°180.0°
C5C3C2C130.1°0.3°
C5C3C2H1180.0°180.0°
C5C3C2CL1178.9°180.0°
N29C30C33H17121.2°120.0°
N29C30C33H18121.3°120.0°
N29C30C33N3513.9°58.4°
N29C30C33C53105.2°61.6°
N29C30H17H18116.1°120.0°
N29C30C33H19135.5°178.4°
C30N29C39H22146.8°179.3°
C30N29C39H2393.5°60.7°
C36N35C42N4310.1°123.6°
C36N35C33C3039.8°59.3°
C36N35C42C33178.4°123.8°
C36N35C42C49168.7°56.2°
C36N35C33C5380.9°60.7°
C36N35C33H19160.6°179.3°
N35C36H20H21119.5°120.0°
N35C36C39H22166.9°178.4°
N35C36C39H2373.4°61.6°
C13C2C3CL1178.8°179.7°
C13C2C3H1180.0°179.7°
C2C13C11H8179.2°180.0°
N43C44C46H2180.0°179.8°
C44N43C42N35179.3°179.7°
C44N43C42C490.5°0.1°
N43C44C46C51178.8°179.7°
N43C44C46C470.0°0.2°
C42N43C44C460.1°0.1°
N43C42N35C49178.8°179.8°
N43C42N35C33171.4°0.2°
N43C42C49C470.8°0.2°
C42N43C44H2179.9°179.7°
N43C42C49H4179.2°179.7°
C3C2C13H9179.5°179.7°
C44C46C51C47178.8°180.0°
C44C46C51N5286.8°79.2°
C44C46C47C490.4°0.5°
C44C46C47H3179.6°180.0°
C30C33N35C42141.7°176.8°
C30C33N35C53120.7°120.0°
C30C33N35H19120.8°120.0°
C30C33C53H19119.4°120.0°
C30C33C53H5180.0°60.0°
C30C33C53H660.0°180.0°
C30C33C53H760.0°60.0°
C33C30H17H18116.0°120.1°
C42N35C33C5397.6°63.2°
N35C42C49C47179.6°180.0°
N35C42C49H40.4°0.0°
C42N35C33H1920.9°56.8°
C42N35C36H20116.6°56.8°
C42N35C36H213.1°63.2°
C33N35C42C499.8°180.0°
N35C33C53H19119.4°120.1°
N35C33C53H558.7°59.9°
N35C33C53H6178.8°60.1°
N35C33C53H761.2°179.9°
N35C33C30H17107.3°61.6°
N35C33C30H18135.2°178.4°
C33N35C36H2061.9°179.3°
C33N35C36H21178.4°60.7°
CL1C2C3H11.2°0.1°
CL1C2C13H90.6°0.0°
C42C49C47C460.7°0.5°
C42C49C47H4180.0°180.0°
C42C49C47H3179.2°180.0°
C33C53H5H6120.1°120.0°
C33C53H5H7120.0°120.1°
C33C53H6H7120.0°120.1°
C53C33C30H17133.6°178.4°
C53C33C30H1816.1°58.4°
C51C46C47C49179.1°179.5°
C51C46C44H21.2°0.0°
C51C46C47H30.9°0.0°
C47C46C51N5291.9°100.9°
C46C47C49H3180.0°179.5°
C47C46C44H2180.0°180.0°
C46C47C49H4179.3°179.5°
H3C47C49H40.7°0.0°
H5C53H6H7120.0°120.0°
H5C53C33H1960.6°180.0°
H6C53C33H1959.4°60.0°
H7C53C33H19179.4°60.0°
H8C11C13H90.8°0.0°
H12C19C21H130.0°0.0°
H13C21C23H140.7°0.1°
H14C23C25H150.7°0.0°
H15C25C27H160.0°0.1°
H17C30C33H1914.2°58.4°
H18C30C33H19103.3°61.6°
H20C36C39H2246.8°61.7°
H20C36C39H23166.4°58.4°
H21C36C39H2272.9°58.4°
H21C36C39H2346.7°178.4°

225946

PDB entries from 2024-10-09

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