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U0J

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C01C03doub0.00Å1.34Å
C01N35sing0.00Å1.36Å
C03N36sing0.00Å1.37Å
C05N35sing0.00Å1.47Å
C09C12sing0.00Å1.50Å
C09N36sing0.00Å1.45Å
C12C13doub0.00Å1.43ÅAromatic
C12C34sing0.00Å1.43ÅAromatic
C13C14sing0.00Å1.43ÅAromatic
C13C22sing0.00Å1.44ÅAromatic
C14C16doub0.00Å1.36ÅAromatic
C16C18sing0.00Å1.40ÅAromatic
C18C20doub0.00Å1.35ÅAromatic
C20C22sing0.00Å1.41ÅAromatic
C22C23doub0.00Å1.39ÅAromatic
C23C25sing0.00Å1.38ÅAromatic
C25C26doub0.00Å1.42ÅAromatic
C25C34sing0.00Å1.46ÅAromatic
C26C28sing0.00Å1.35ÅAromatic
C28C30doub0.00Å1.41ÅAromatic
C30C32sing0.00Å1.35ÅAromatic
C32C34doub0.00Å1.43ÅAromatic
N35C43sing0.00Å1.31Å
N36C43sing0.00Å1.35Å
RU39C43sing0.00Å2.31Å
RU39CL37sing0.00Å2.42Å
RU39CL38sing0.00Å2.44Å
C01H1sing0.00Å1.08Å
C03H2sing0.00Å1.08Å
C05H3sing0.00Å1.10Å
C05H4sing0.00Å1.10Å
C05H5sing0.00Å1.10Å
C09H6sing0.00Å1.10Å
C09H7sing0.00Å1.10Å
C14H8sing0.00Å1.08Å
C16H9sing0.00Å1.08Å
C18H10sing0.00Å1.08Å
C20H11sing0.00Å1.08Å
C23H12sing0.00Å1.08Å
C26H13sing0.00Å1.08Å
C28H14sing0.00Å1.08Å
C30H15sing0.00Å1.08Å
C32H16sing0.00Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C03C01N35108.9°90.0°
C01C03N36107.0°90.0°
C03C01H1125.6°90.0°
C01C03H2126.5°90.0°
C01N35C05124.9°90.0°
C01N35C43107.1°90.0°
N35C01H1125.5°90.0°
C03N36C09130.8°90.0°
C03N36C43106.6°90.0°
N36C03H2126.6°90.0°
C05N35C43128.1°90.0°
N35C05H3109.5°90.0°
N35C05H4109.5°90.0°
N35C05H5109.5°90.0°
C12C09N36112.9°90.0°
C09C12C13119.5°90.0°
C09C12C34119.8°90.0°
C12C09H6108.6°90.0°
C12C09H7108.6°90.0°
C09N36C43122.6°90.0°
N36C09H6108.6°90.0°
N36C09H7108.6°90.0°
C13C12C34120.8°90.0°
C12C13C14125.2°90.0°
C12C13C22119.2°90.0°
C12C34C25117.5°90.0°
C12C34C32125.7°90.0°
C14C13C22115.5°90.0°
C13C14C16122.6°90.0°
C13C14H8118.7°90.0°
C13C22C20119.8°90.0°
C13C22C23119.9°90.0°
C14C16C18120.6°90.0°
C16C14H8118.7°90.0°
C14C16H9119.7°90.0°
C16C18C20119.9°90.0°
C18C16H9119.7°90.0°
C16C18H10120.0°90.0°
C18C20C22121.5°90.0°
C20C18H10120.1°90.0°
C18C20H11119.2°90.0°
C20C22C23120.3°90.0°
C22C20H11119.3°90.0°
C22C23C25121.6°90.0°
C22C23H12119.2°90.0°
C23C25C26119.5°90.0°
C23C25C34121.1°90.0°
C25C23H12119.2°90.0°
C26C25C34119.4°90.0°
C25C26C28120.4°90.0°
C25C26H13119.8°90.0°
C25C34C32116.8°90.0°
C26C28C30121.1°90.0°
C28C26H13119.8°90.0°
C26C28H14119.5°90.0°
C28C30C32121.2°90.0°
C30C28H14119.5°90.0°
C28C30H15119.4°90.0°
C30C32C34121.1°90.0°
C32C30H15119.4°90.0°
C30C32H16119.4°90.0°
C34C32H16119.5°90.0°
N35C43N36110.5°90.0°
N35C43RU39123.8°90.0°
N36C43RU39125.7°90.0°
C43RU39CL3787.1°90.0°
C43RU39CL3893.7°90.0°
CL37RU39CL3880.2°90.0°
H3C05H4109.4°90.0°
H3C05H5109.5°90.0°
H4C05H5109.5°90.0°
H6C09H7109.5°90.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C03C01N35H1180.0°90.0°
C01C03N36H2180.0°90.0°
C03C01N35C05179.1°90.0°
C01C03N36C09179.3°90.0°
C03C01N35C430.3°90.0°
C01C03N36C431.8°90.0°
N35C01C03N360.9°90.0°
C01N35C05C43178.5°90.0°
C01N35C43N361.5°90.0°
C01N35C43RU39179.3°90.0°
N35C01C03H2179.1°90.0°
C01N35C05H3180.0°90.0°
C01N35C05H460.0°90.0°
C01N35C05H560.0°90.0°
C03N36C09C121.3°90.0°
C03N36C09C43178.8°90.0°
C03N36C43N352.1°90.0°
C03N36C43RU39179.8°90.0°
N36C03C01H1179.1°90.0°
C03N36C09H6119.3°90.0°
C03N36C09H7121.8°90.0°
C05N35C43N36179.8°90.0°
C05N35C43RU392.0°90.0°
C05N35C01H10.9°90.0°
N35C05H3H4120.0°90.0°
N35C05H3H5120.0°90.0°
N35C05H4H5120.0°90.0°
C12C09N36H6120.5°90.0°
C12C09N36H7120.5°90.0°
C09C12C13C34179.9°90.0°
C09C12C13C142.6°90.0°
C09C12C13C22179.4°90.0°
C09C12C34C25177.9°90.0°
C09C12C34C321.7°90.0°
C12C09N36C43177.5°90.0°
C12C09H6H7118.4°90.0°
N36C09C12C1376.5°90.0°
N36C09C12C34103.6°90.0°
C09N36C43N35178.9°90.0°
C09N36C43RU391.1°90.0°
C09N36C03H20.7°90.0°
N36C09H6H7118.4°90.0°
C12C13C14C22178.1°90.0°
C12C13C14C16177.9°90.0°
C12C13C22C20178.6°90.0°
C12C13C22C230.1°90.0°
C13C12C34C252.1°90.0°
C13C12C34C32178.2°90.0°
C13C12C09H644.0°90.0°
C13C12C09H7163.0°90.0°
C12C13C14H82.1°90.0°
C34C12C13C14177.5°90.0°
C34C12C13C220.5°90.0°
C12C34C25C233.3°90.0°
C12C34C25C26179.2°90.0°
C12C34C25C32176.5°90.0°
C12C34C32C30178.7°90.0°
C34C12C09H6135.9°90.0°
C34C12C09H716.9°90.0°
C12C34C32H161.3°90.0°
C13C14C16H8180.0°90.0°
C13C14C16C181.2°90.0°
C14C13C22C200.4°90.0°
C14C13C22C23178.1°90.0°
C13C14C16H9178.8°90.0°
C22C13C14C160.2°90.0°
C13C22C20C180.2°90.0°
C13C22C20C23178.5°90.0°
C13C22C23C251.3°90.0°
C22C13C14H8179.9°90.0°
C13C22C20H11179.8°90.0°
C13C22C23H12178.7°90.0°
C14C16C18H9180.0°90.0°
C14C16C18C201.8°90.0°
C14C16C18H10178.2°90.0°
C16C18C20H10180.0°90.0°
C16C18C20C221.2°90.0°
C18C16C14H8178.8°90.0°
C16C18C20H11178.8°90.0°
C18C20C22H11180.0°90.0°
C18C20C22C23178.7°90.0°
C20C18C16H9178.3°90.0°
C20C22C23C25179.8°90.0°
C22C20C18H10178.8°90.0°
C20C22C23H120.2°90.0°
C22C23C25H12180.0°90.0°
C22C23C25C26179.6°90.0°
C22C23C25C342.9°90.0°
C23C22C20H111.3°90.0°
C23C25C26C34177.5°90.0°
C23C25C26C28178.6°90.0°
C23C25C34C32179.8°90.0°
C23C25C26H131.4°90.0°
C25C26C28H13180.0°90.0°
C25C26C28C301.0°90.0°
C26C25C34C322.7°90.0°
C26C25C23H120.4°90.0°
C25C26C28H14179.0°90.0°
C34C25C26C281.0°90.0°
C25C34C32C302.6°90.0°
C34C25C23H12177.1°90.0°
C34C25C26H13178.9°90.0°
C25C34C32H16177.4°90.0°
C26C28C30H14180.0°90.0°
C26C28C30C321.2°90.0°
C26C28C30H15178.8°90.0°
C28C30C32H15180.0°90.0°
C28C30C32C340.7°90.0°
C30C28C26H13179.1°90.0°
C28C30C32H16179.3°90.0°
C30C32C34H16180.0°90.0°
C32C30C28H14178.7°90.0°
C34C32C30H15179.3°90.0°
N35C43N36RU39177.8°90.0°
N35C43RU39CL37117.7°90.0°
N35C43RU39CL3837.7°90.0°
C43N35C01H1179.7°90.0°
C43N35C05H31.5°90.0°
C43N35C05H4118.5°90.0°
C43N35C05H5121.5°90.0°
N36C43RU39CL3764.8°90.0°
N36C43RU39CL38144.8°90.0°
C43N36C03H2178.2°90.0°
C43N36C09H661.9°90.0°
C43N36C09H757.0°90.0°
C43RU39CL37CL3894.2°90.0°
H1C01C03H20.9°90.0°
H3C05H4H5120.0°90.0°
H8C14C16H91.2°90.0°
H9C16C18H101.7°90.0°
H10C18C20H111.2°90.0°
H13C26C28H141.0°90.0°
H14C28C30H151.2°90.0°
H15C30C32H160.7°90.0°

222415

PDB entries from 2024-07-10

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