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KJ1

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C01C02sing1.53Å1.54Å
C02C03sing1.53Å1.52Å
C03C04sing1.53Å1.53Å
C04C05sing1.53Å1.55Å
C05C06sing1.53Å1.54Å
C06C07sing1.53Å1.54Å
C07C08sing1.53Å1.52Å
C08C09sing1.51Å1.52Å
C09O10doub1.21Å1.20Å
C09N11sing1.35Å1.44Å
N11C12sing1.46Å1.48Å
C13C12sing1.53Å1.54Å
C13C14sing1.53Å1.56Å
N20C19sing1.35Å1.44Å
C14C15sing1.53Å1.55Å
C16C15sing1.53Å1.57Å
C16C17sing1.53Å1.55Å
C19O21doub1.21Å1.22Å
C19C18sing1.51Å1.54Å
C18C17sing1.53Å1.57Å
C13H1sing1.09Å1.10Å
C13H2sing1.09Å1.10Å
C15H3sing1.09Å1.10Å
C15H4sing1.09Å1.10Å
C17H5sing1.09Å1.10Å
C01H6sing1.09Å1.10Å
C01H7sing1.09Å1.10Å
C01H8sing1.09Å1.10Å
C02H9sing1.09Å1.10Å
C02H10sing1.09Å1.10Å
C03H11sing1.09Å1.10Å
C03H12sing1.09Å1.10Å
C04H13sing1.09Å1.10Å
C04H14sing1.09Å1.10Å
C05H15sing1.09Å1.10Å
C05H16sing1.09Å1.10Å
C06H17sing1.09Å1.10Å
C06H18sing1.09Å1.10Å
C07H19sing1.09Å1.10Å
C07H20sing1.09Å1.10Å
C08H21sing1.09Å1.10Å
C08H22sing1.09Å1.10Å
N11H23sing0.97Å1.00Å
C12H24sing1.09Å1.10Å
C12H25sing1.09Å1.10Å
C14H26sing1.09Å1.10Å
C14H27sing1.09Å1.10Å
C16H28sing1.09Å1.10Å
C18H29sing1.09Å1.10Å
C18H30sing1.09Å1.10Å
N20H31sing0.97Å1.00Å
N20H32sing0.97Å1.00Å
C17H33sing1.09Å1.10Å
C16H34sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C01C02C03110.2°109.5°
C02C01H6109.5°109.5°
C02C01H7109.5°109.5°
C02C01H8109.5°109.5°
C01C02H9109.3°109.5°
C01C02H10109.3°109.5°
C02C03C04110.5°109.5°
C03C02H9109.3°109.5°
C03C02H10109.3°109.5°
C02C03H11109.2°109.5°
C02C03H12109.2°109.5°
C03C04C05113.0°109.5°
C04C03H11109.2°109.5°
C04C03H12109.2°109.5°
C03C04H13108.6°109.5°
C03C04H14108.6°109.5°
C04C05C06109.0°109.5°
C05C04H13108.6°109.5°
C05C04H14108.6°109.5°
C04C05H15109.6°109.5°
C04C05H16109.5°109.5°
C05C06C07112.3°109.5°
C06C05H15109.6°109.5°
C06C05H16109.6°109.5°
C05C06H17108.7°109.4°
C05C06H18108.8°109.4°
C06C07C08108.0°109.5°
C07C06H17108.7°109.5°
C07C06H18108.7°109.5°
C06C07H19109.9°109.5°
C06C07H20109.8°109.5°
C07C08C09112.6°109.5°
C08C07H19109.8°109.5°
C08C07H20109.8°109.5°
C07C08H21108.7°109.5°
C07C08H22108.7°109.5°
C08C09O10121.0°120.0°
C08C09N11117.4°120.0°
C09C08H21108.7°109.5°
C09C08H22108.7°109.5°
O10C09N11121.6°120.0°
C09N11C12121.0°120.0°
C09N11H23119.5°120.0°
N11C12C13111.2°109.5°
C12N11H23119.5°120.0°
N11C12H24109.0°109.5°
N11C12H25109.0°109.5°
C12C13C14114.1°109.5°
C12C13H1108.3°109.5°
C12C13H2108.3°109.5°
C13C12H24109.0°109.5°
C13C12H25109.0°109.5°
C13C14C15116.9°109.5°
C14C13H1108.3°109.5°
C14C13H2108.3°109.5°
C13C14H26107.6°109.5°
C13C14H27107.6°109.5°
N20C19O21119.1°120.0°
N20C19C18115.1°120.0°
C19N20H31120.0°120.0°
C19N20H32120.0°120.0°
C14C15C16115.4°109.5°
C14C15H3108.0°109.5°
C14C15H4108.0°109.5°
C15C14H26107.6°109.5°
C15C14H27107.6°109.5°
C15C16C17119.3°109.5°
C16C15H3108.0°109.5°
C16C15H4108.0°109.5°
C15C16H28107.0°109.5°
C15C16H34107.0°109.5°
C16C17C18119.3°109.5°
C16C17H5106.9°109.5°
C17C16H28107.0°109.5°
C16C17H33107.0°109.5°
C17C16H34107.0°109.5°
O21C19C18125.7°120.0°
C19C18C17111.8°109.5°
C19C18H29108.9°109.5°
C19C18H30108.9°109.5°
C18C17H5107.0°109.5°
C17C18H29108.9°109.5°
C17C18H30108.9°109.5°
C18C17H33107.0°109.5°
H1C13H2109.5°109.5°
H3C15H4109.5°109.4°
H5C17H33109.5°109.5°
H6C01H7109.5°109.5°
H6C01H8109.5°109.4°
H7C01H8109.4°109.5°
H9C02H10109.5°109.4°
H11C03H12109.4°109.5°
H13C04H14109.5°109.5°
H15C05H16109.5°109.5°
H17C06H18109.5°109.5°
H19C07H20109.5°109.4°
H21C08H22109.5°109.4°
H24C12H25109.5°109.5°
H26C14H27109.5°109.4°
H28C16H34109.5°109.5°
H29C18H30109.5°109.5°
H31N20H32120.0°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C01C02C03H9120.1°120.0°
C01C02C03H10120.1°120.0°
C01C02C03C0455.8°180.0°
C02C01H6H7120.0°120.1°
C02C01H6H8120.0°120.0°
C02C01H7H8120.0°120.0°
C01C02H9H10119.7°120.0°
C01C02C03H1164.3°60.0°
C01C02C03H12176.0°60.0°
C02C03C04H11120.2°120.0°
C02C03C04H12120.2°120.0°
C02C03C04C0568.9°180.0°
C03C02C01H6180.0°60.0°
C03C02C01H760.0°180.0°
C03C02C01H860.0°60.0°
C03C02H9H10119.7°120.0°
C02C03H11H12119.6°120.0°
C02C03C04H1351.7°60.0°
C02C03C04H14170.6°60.0°
C03C04C05H13120.5°120.0°
C03C04C05H14120.5°120.0°
C03C04C05C06175.9°180.0°
C04C03C02H9176.0°60.0°
C04C03C02H1064.2°60.0°
C04C03H11H12119.5°120.0°
C03C04H13H14118.4°120.0°
C03C04C05H1556.0°60.0°
C03C04C05H1664.1°60.0°
C04C05C06H15119.9°120.0°
C04C05C06H16119.9°120.0°
C04C05C06C07174.4°180.0°
C05C04C03H11171.0°60.0°
C05C04C03H1251.3°60.0°
C05C04H13H14118.4°120.0°
C04C05H15H16120.2°120.0°
C04C05C06H1765.2°60.0°
C04C05C06H1853.9°60.0°
C05C06C07H17120.4°120.0°
C05C06C07H18120.5°120.0°
C05C06C07C08167.0°180.0°
C06C05C04H1363.6°60.0°
C06C05C04H1455.4°60.0°
C06C05H15H16120.2°120.0°
C05C06H17H18118.7°119.9°
C05C06C07H1947.2°60.0°
C05C06C07H2073.3°60.0°
C06C07C08H19119.8°120.0°
C06C07C08H20119.8°120.0°
C06C07C08C09176.0°180.0°
C07C06C05H1554.4°60.0°
C07C06C05H1665.7°60.0°
C07C06H17H18118.7°120.1°
C06C07H19H20120.7°120.0°
C06C07C08H2155.6°60.0°
C06C07C08H2263.5°60.0°
C07C08C09H21120.5°120.0°
C07C08C09H22120.5°120.0°
C07C08C09O1039.7°0.0°
C07C08C09N11139.7°180.0°
C08C07C06H1772.6°60.0°
C08C07C06H1846.5°60.0°
C08C07H19H20120.7°120.0°
C07C08H21H22118.6°120.0°
C08C09O10N11179.5°180.0°
C08C09N11C12179.9°180.0°
C09C08C07H1964.2°60.0°
C09C08C07H2056.2°60.0°
C09C08H21H22118.6°120.0°
C08C09N11H230.1°0.0°
O10C09N11C120.6°0.0°
O10C09C08H21160.2°120.0°
O10C09C08H2280.7°120.0°
O10C09N11H23179.4°180.0°
C09N11C12H23180.0°180.0°
C09N11C12C13120.9°180.0°
N11C09C08H2119.3°60.0°
N11C09C08H2299.8°60.0°
C09N11C12H24118.8°60.0°
C09N11C12H250.7°60.0°
N11C12C13H24120.2°120.0°
N11C12C13H25120.2°120.0°
N11C12C13C14162.9°180.0°
N11C12C13H176.4°60.0°
N11C12C13H242.3°60.0°
N11C12H24H25119.2°120.0°
C12C13C14H1120.7°120.0°
C12C13C14H2120.7°120.0°
C12C13C14C15118.8°180.0°
C12C13H1H2117.9°120.0°
C13C12N11H2359.1°0.0°
C13C12H24H25119.2°120.0°
C12C13C14H262.3°60.0°
C12C13C14H27120.2°60.0°
C13C14C15H26121.1°120.0°
C13C14C15H27121.1°120.0°
C13C14C15C16129.5°180.0°
C14C13H1H2117.9°120.0°
C13C14C15H38.6°60.0°
C13C14C15H4109.6°60.0°
C14C13C12H2442.7°60.0°
C14C13C12H2576.8°60.0°
C13C14H26H27116.6°120.0°
N20C19O21C18178.5°180.0°
N20C19C18C1746.7°180.0°
N20C19C18H2973.6°60.0°
N20C19C18H30167.1°60.0°
C19N20H31H32180.0°180.0°
C14C15C16H3120.9°120.0°
C14C15C16H4120.9°120.0°
C14C15C16C17127.7°180.0°
C15C14C13H1120.5°60.0°
C15C14C13H21.9°60.0°
C14C15H3H4117.3°120.0°
C15C14H26H27116.6°120.0°
C14C15C16H286.4°60.0°
C14C15C16H34110.9°60.0°
C15C16C17H28121.4°120.0°
C15C16C17H34121.4°120.0°
C15C16C17C18174.9°180.0°
C16C15H3H4117.3°120.0°
C15C16C17H553.5°60.0°
C16C15C14H26109.4°60.0°
C16C15C14H278.5°60.0°
C15C16H28H34115.6°120.0°
C15C16C17H3363.7°60.0°
C16C17C18C1988.6°180.0°
C16C17C18H5121.4°120.0°
C16C17C18H33121.4°120.0°
C17C16C15H3111.4°60.0°
C17C16C15H46.9°60.0°
C16C17H5H33115.5°120.0°
C17C16H28H34115.5°120.0°
C16C17C18H2931.8°60.0°
C16C17C18H30151.1°60.0°
O21C19C18C17134.7°0.0°
O21C19C18H29104.9°120.0°
O21C19C18H3014.4°120.0°
O21C19N20H310.0°0.0°
O21C19N20H32180.0°180.0°
C19C18C17H29120.3°120.0°
C19C18C17H30120.4°120.0°
C19C18C17H532.8°60.0°
C19C18H29H30118.9°120.0°
C18C19N20H31178.6°180.0°
C18C19N20H321.3°0.0°
C19C18C17H33150.0°60.0°
C18C17H5H33115.6°120.0°
C18C17C16H2863.8°60.0°
C17C18H29H30119.0°120.0°
C18C17C16H3453.5°60.0°
H1C13C12H24163.4°60.0°
H1C13C12H2543.9°180.0°
H1C13C14H26118.4°180.0°
H1C13C14H270.5°60.0°
H2C13C12H2478.0°180.0°
H2C13C12H25162.5°60.0°
H2C13C14H26123.0°60.0°
H2C13C14H27119.2°180.0°
H3C15C14H26129.7°180.0°
H3C15C14H27112.4°60.1°
H3C15C16H28127.3°180.0°
H3C15C16H3410.0°60.0°
H4C15C14H2611.5°60.1°
H4C15C14H27129.3°180.0°
H4C15C16H28114.5°60.0°
H4C15C16H34128.3°180.0°
H5C17C16H28174.8°180.0°
H5C17C18H29153.1°180.0°
H5C17C18H3087.5°60.0°
H5C17C16H3467.9°60.0°
H6C01H7H8120.0°119.9°
H6C01C02H959.9°NaN°
H6C01C02H1059.9°60.1°
H7C01C02H960.1°60.0°
H7C01C02H10179.9°60.0°
H8C01C02H9179.9°60.1°
H8C01C02H1060.1°NaN°
H9C02C03H1155.8°180.0°
H9C02C03H1263.9°60.0°
H10C02C03H11175.6°60.0°
H10C02C03H1255.9°180.0°
H11C03C04H1368.5°180.0°
H11C03C04H1450.4°60.0°
H12C03C04H13171.8°60.0°
H12C03C04H1469.2°180.0°
H13C04C05H15176.5°180.0°
H13C04C05H1656.4°60.0°
H14C04C05H1564.5°60.0°
H14C04C05H16175.3°180.0°
H15C05C06H17174.9°180.0°
H15C05C06H1866.0°60.0°
H16C05C06H1754.7°60.0°
H16C05C06H18173.8°180.0°
H17C06C07H19167.6°179.9°
H17C06C07H2047.2°60.0°
H18C06C07H1973.2°60.0°
H18C06C07H20166.3°179.9°
H19C07C08H21175.4°NaN°
H19C07C08H2256.3°60.1°
H20C07C08H2164.2°60.1°
H20C07C08H22176.7°NaN°
H23N11C12H2461.2°120.0°
H23N11C12H25179.3°120.0°
H28C16C17H3357.6°60.0°
H29C18C17H3389.6°60.0°
H30C18C17H3329.7°180.0°
H33C17C16H34174.9°180.0°

222624

PDB entries from 2024-07-17

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