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CJD

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O19C18doub1.22Å1.22Å
CL24C3sing1.74Å1.73Å
C11C10sing1.53Å1.51Å
C11C4sing1.51Å1.51Å
C10N9sing1.46Å1.48Å
C18N17sing1.35Å1.39Å
C18C13sing1.40Å1.52Å
C4C3doub1.38Å1.42ÅAromatic
C4C5sing1.40Å1.45ÅAromatic
C3C2sing1.39Å1.41ÅAromatic
C12N9sing1.46Å1.46Å
C12C13sing1.51Å1.50Å
N9C8sing1.35Å1.42Å
N17C16sing1.36Å1.39Å
C13C14doub1.38Å1.37Å
C8C5sing1.48Å1.52Å
C8O23doub1.22Å1.25Å
C5C6doub1.39Å1.44ÅAromatic
C2C1doub1.38Å1.44ÅAromatic
C16C20sing1.51Å1.49Å
C16C15doub1.35Å1.35Å
C14C15sing1.41Å1.49Å
C14O21sing1.36Å1.41Å
C6C1sing1.38Å1.43ÅAromatic
C6CL7sing1.74Å1.73Å
C1C25sing1.51Å1.53Å
O21C22sing1.43Å1.44Å
C29C26sing1.54Å1.51Å
C29O28sing1.44Å1.47Å
C26C25sing1.53Å1.52Å
C26C27sing1.54Å1.54Å
C25O30sing1.43Å1.43Å
O30C31sing1.43Å1.43Å
O28C27sing1.44Å1.44Å
C10H1sing1.09Å1.10Å
C10H2sing1.09Å1.10Å
C15H4sing1.08Å1.08Å
C20H5sing1.09Å1.10Å
C20H6sing1.09Å1.10Å
C20H7sing1.09Å1.10Å
C22H8sing1.09Å1.10Å
C22H9sing1.09Å1.10Å
C22H10sing1.09Å1.10Å
C26H11sing1.09Å1.10Å
C2H12sing1.08Å1.08Å
C11H13sing1.09Å1.10Å
C11H14sing1.09Å1.10Å
C12H15sing1.09Å1.10Å
C12H16sing1.09Å1.10Å
C25H17sing1.09Å1.10Å
C27H18sing1.09Å1.10Å
C27H19sing1.09Å1.10Å
C29H20sing1.09Å1.10Å
C29H21sing1.09Å1.10Å
C31H22sing1.09Å1.10Å
C31H23sing1.09Å1.10Å
C31H24sing1.09Å1.10Å
N17H3sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O19C18N17122.4°120.0°
O19C18C13121.7°119.9°
CL24C3C4122.3°120.1°
CL24C3C2117.3°120.0°
C10C11C4111.4°110.1°
C11C10N9113.0°111.0°
C11C10H1108.6°109.2°
C11C10H2108.6°109.1°
C10C11H13109.0°109.4°
C10C11H14109.0°109.4°
C11C4C3120.5°120.7°
C11C4C5119.5°119.5°
C4C11H13109.0°109.3°
C4C11H14109.0°109.4°
C10N9C12119.0°119.4°
C10N9C8121.2°121.1°
N9C10H1108.6°109.2°
N9C10H2108.6°109.2°
N17C18C13115.9°120.1°
C18N17C16125.1°121.1°
C18N17H3117.5°119.5°
C18C13C12117.6°120.5°
C18C13C14118.8°119.1°
C3C4C5119.4°119.8°
C4C3C2120.4°120.0°
C4C5C8117.7°119.0°
C4C5C6119.8°120.0°
C3C2C1121.2°120.4°
C3C2H12119.4°119.8°
N9C12C13108.9°109.5°
C12N9C8119.5°119.5°
N9C12H15109.6°109.5°
N9C12H16109.6°109.5°
C12C13C14123.6°120.4°
C13C12H15109.6°109.4°
C13C12H16109.6°109.5°
N9C8C5115.9°119.4°
N9C8O23123.5°120.3°
N17C16C20116.6°119.6°
N17C16C15119.6°120.8°
C16N17H3117.4°119.4°
C13C14C15120.5°119.0°
C13C14O21120.4°120.5°
C5C8O23120.7°120.3°
C8C5C6122.5°120.9°
C5C6C1120.1°119.6°
C5C6CL7121.3°120.2°
C2C1C6118.9°120.1°
C2C1C25118.6°119.9°
C1C2H12119.4°119.8°
C20C16C15123.8°119.6°
C16C20H5109.5°109.4°
C16C20H6109.5°109.5°
C16C20H7109.5°109.4°
C16C15C14120.1°119.8°
C16C15H4119.9°120.1°
C15C14O21119.1°120.5°
C14C15H4120.0°120.1°
C14O21C22117.1°117.0°
C1C6CL7118.6°120.2°
C6C1C25122.5°119.9°
C1C25C26112.0°109.4°
C1C25O30109.7°109.5°
C1C25H17108.9°109.5°
O21C22H8109.5°109.5°
O21C22H9109.5°109.5°
O21C22H10109.5°109.5°
C26C29O2889.6°85.5°
C29C26C25125.2°113.8°
C29C26C2785.4°85.8°
C29C26H11110.2°113.9°
C26C29H20114.2°113.8°
C26C29H21114.2°113.8°
C29O28C2790.4°93.4°
O28C29H20114.2°113.9°
O28C29H21114.2°113.9°
C25C26C27113.2°113.8°
C26C25O30107.0°109.5°
C25C26H11110.2°113.0°
C26C25H17109.1°109.5°
C26C27O2890.0°85.5°
C27C26H11109.9°113.8°
C26C27H18114.1°113.8°
C26C27H19114.1°113.9°
C25O30C31115.2°114.0°
O30C25H17110.3°109.5°
O30C31H22109.5°109.5°
O30C31H23109.4°109.5°
O30C31H24109.5°109.4°
O28C27H18114.1°113.9°
O28C27H19114.1°114.0°
H1C10H2109.5°109.2°
H5C20H6109.4°109.4°
H5C20H7109.5°109.5°
H6C20H7109.5°109.5°
H8C22H9109.4°109.4°
H8C22H10109.5°109.4°
H9C22H10109.5°109.5°
H13C11H14109.5°109.3°
H15C12H16109.5°109.4°
H18C27H19109.5°113.0°
H20C29H21109.5°113.2°
H22C31H23109.4°109.4°
H22C31H24109.5°109.5°
H23C31H24109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O19C18N17C13179.7°179.9°
O19C18C13C120.3°0.2°
O19C18N17C16180.0°179.4°
O19C18C13C14180.0°180.0°
O19C18N17H30.0°0.2°
CL24C3C4C1110.5°1.5°
CL24C3C4C2179.4°179.9°
CL24C3C4C5178.5°179.3°
CL24C3C2C1179.4°180.0°
CL24C3C2H120.6°0.1°
C10C11C4H13120.3°120.2°
C10C11C4H14120.3°120.2°
C11C10N9H1120.5°120.4°
C11C10N9H2120.5°120.3°
C10C11C4C3142.4°146.9°
C10C11C4C528.6°33.9°
C11C10N9C12141.1°140.1°
C11C10N9C833.9°39.9°
C11C10H1H2118.4°119.2°
C10C11H13H14119.1°119.7°
C4C11C10N949.7°50.5°
C11C4C3C5171.0°179.2°
C11C4C3C2168.9°178.4°
C11C4C5C810.2°2.8°
C11C4C5C6168.1°178.2°
C4C11C10H170.9°69.9°
C4C11C10H2170.2°170.9°
C4C11H13H14119.1°119.7°
C10N9C12C8175.1°180.0°
C10N9C12C1367.7°84.4°
C10N9C8C55.6°7.9°
C10N9C8O23173.4°172.2°
N9C10H1H2118.4°119.3°
N9C10C11H1370.6°69.6°
N9C10C11H14170.0°170.7°
C10N9C12H1552.1°35.6°
C10N9C12H16172.3°155.6°
N17C18C13C12180.0°179.7°
C18N17C16H3180.0°179.6°
N17C18C13C140.3°0.1°
C18N17C16C20180.0°179.7°
C18N17C16C150.1°0.9°
C18C13C12N9101.4°83.4°
C18C13C12C14179.7°179.8°
C13C18N17C160.2°0.7°
C18C13C14C150.3°0.3°
C18C13C14O21179.7°179.8°
C18C13C12H1518.5°36.6°
C18C13C12H16138.7°156.5°
C13C18N17H3179.8°179.7°
C3C4C5C8178.8°178.0°
C3C4C5C63.0°1.1°
C4C3C2C10.1°0.1°
C4C3C2H12179.9°180.0°
C3C4C11H1397.3°92.9°
C3C4C11H1422.2°26.7°
C5C4C3C22.1°0.8°
C4C5C8N928.2°12.2°
C4C5C8C6178.2°179.1°
C4C5C8O23150.8°167.7°
C4C5C6C11.7°0.7°
C4C5C6CL7177.4°179.2°
C5C4C11H1391.8°86.3°
C5C4C11H14148.8°154.1°
C3C2C1H12180.0°179.9°
C3C2C1C61.3°0.3°
C3C2C1C25177.9°179.7°
N9C12C13H15119.9°120.0°
N9C12C13H16119.9°120.0°
N9C12C13C1479.0°96.8°
C12N9C8C5179.5°172.1°
C12N9C8O231.5°7.8°
C12N9C10H198.4°99.5°
C12N9C10H220.5°19.8°
N9C12H15H16120.2°120.0°
C13C12N9C8117.2°95.6°
C12C13C14C15180.0°180.0°
C12C13C14O210.0°0.0°
C13C12H15H16120.3°120.0°
N9C8C5O23179.0°179.9°
N9C8C5C6150.0°166.8°
C8N9C10H186.6°80.5°
C8N9C10H2154.5°160.2°
C8N9C12H15122.9°144.4°
C8N9C12H162.7°24.5°
N17C16C20C15179.9°179.4°
N17C16C15C140.1°0.6°
N17C16C15H4179.9°179.4°
N17C16C20H5180.0°89.4°
N17C16C20H660.0°30.5°
N17C16C20H760.0°150.6°
C13C14C15C160.2°0.0°
C13C14C15O21180.0°180.0°
C13C14O21C22171.4°114.6°
C13C14C15H4179.8°180.0°
C14C13C12H15161.2°143.2°
C14C13C12H1641.0°23.3°
C8C5C6C1179.9°178.4°
C8C5C6CL70.8°1.7°
O23C8C5C631.0°13.2°
C5C6C1C20.4°0.0°
C5C6C1CL7179.2°179.9°
C5C6C1C25178.8°180.0°
C2C1C6C25179.2°180.0°
C2C1C6CL7179.6°179.9°
C2C1C25C2665.5°95.0°
C2C1C25O3053.1°25.0°
C2C1C25H17173.8°145.0°
C20C16C15C14179.9°180.0°
C20C16C15H40.1°0.0°
C16C20H5H6120.0°120.0°
C16C20H5H7120.0°120.0°
C16C20H6H7120.0°120.0°
C20C16N17H30.0°0.0°
C16C15C14H4180.0°180.0°
C16C15C14O21179.8°180.0°
C15C16C20H50.1°90.0°
C15C16C20H6119.8°150.0°
C15C16C20H7120.1°30.0°
C15C16N17H3179.9°179.5°
C15C14O21C228.6°65.4°
O21C14C15H40.2°0.1°
C14O21C22H8180.0°54.6°
C14O21C22H960.0°65.4°
C14O21C22H1060.0°174.6°
C6C1C25C26115.3°85.0°
C6C1C25O30126.1°155.0°
C6C1C2H12178.7°179.6°
C6C1C25H175.4°35.0°
CL7C6C1C250.4°0.1°
C1C25C26C2978.4°88.4°
C1C25C26O30120.2°120.0°
C1C25C26H17120.6°120.0°
C1C25C26C27179.7°175.5°
C1C25O30H17119.9°120.0°
C1C25O30C3176.8°118.1°
C1C25C26H1156.8°43.7°
C25C1C2H122.1°0.4°
O21C22H8H9120.0°120.0°
O21C22H8H10120.0°120.0°
O21C22H9H10120.0°120.1°
C26C29O28H20116.5°114.1°
C26C29O28H21116.5°114.1°
C29C26C25C27101.3°96.1°
C29C26C25H11135.2°132.0°
C29C26C27H11109.8°114.4°
C29C26C25O30161.4°151.6°
C26C29O28C2716.6°24.2°
C29C26C25H1742.2°31.6°
C29C26C27H18132.6°136.8°
C29C26C27H19100.6°91.7°
C26C29H20H21129.4°132.0°
O28C29C26C25130.9°136.8°
O28C29C26H1193.9°91.6°
C29O28C27H18133.0°138.3°
C29O28C27H19100.2°90.0°
O28C29H20H21129.4°132.1°
C25C26C27H11123.7°131.4°
C26C25O30H17118.5°120.0°
C26C25O30C31161.6°121.9°
C25C26C27O28142.5°136.8°
C25C26C27H18100.9°109.0°
C25C26C27H1925.9°22.5°
C25C26C29H2014.5°22.6°
C25C26C29H21112.5°109.1°
C27C26C25O3060.1°55.5°
C26C27O28H18116.5°114.1°
C26C27O28H19116.6°114.2°
C27C26C25H1759.1°64.5°
C26C27H18H19129.2°131.9°
C27C26C29H20100.8°91.6°
C27C26C29H21132.2°136.7°
O30C25C26H1163.4°76.3°
C25O30C31H22180.0°179.4°
C25O30C31H2360.0°60.6°
C25O30C31H2460.0°59.4°
C31O30C25H1743.1°1.9°
O30C31H22H23120.0°120.0°
O30C31H22H24120.0°120.0°
O30C31H23H24120.0°120.0°
O28C27C26H1193.8°91.8°
O28C27H18H19129.3°132.2°
C27O28C29H2099.8°89.9°
C27O28C29H21133.1°138.3°
H1C10C11H13168.9°170.0°
H1C10C11H1449.4°50.3°
H2C10C11H1349.9°50.7°
H2C10C11H1469.5°68.9°
H5C20H6H7120.0°120.0°
H8C22H9H10120.0°119.9°
H11C26C25H17177.4°163.7°
H11C26C27H1822.7°22.4°
H11C26C27H19149.6°154.0°
H11C26C29H20149.6°154.2°
H11C26C29H2122.6°22.5°
H22C31H23H24120.0°120.0°

222415

PDB entries from 2024-07-10

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