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66R

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O28C27doub1.21Å1.26Å
C36C35doub1.37Å1.39ÅAromatic
C36C30sing1.40Å1.43ÅAromatic
C27O29sing1.34Å1.26Å
C27C25sing1.51Å1.49Å
C35C34sing1.38Å1.38ÅAromatic
C24C25sing1.53Å1.54Å
C24C23sing1.51Å1.50Å
C25N26sing1.47Å1.51Å
C30C23sing1.45Å1.48ÅAromatic
C30C31doub1.42Å1.35ÅAromatic
C23C22doub1.35Å1.32ÅAromatic
C34C33doub1.38Å1.39ÅAromatic
N26C21sing1.47Å1.48Å
C31C33sing1.39Å1.44ÅAromatic
C31N32sing1.37Å1.35ÅAromatic
C22N32sing1.37Å1.37ÅAromatic
C22C21sing1.51Å1.54Å
C21C19sing1.51Å1.55Å
C18C19doub1.38Å1.39ÅAromatic
C18C17sing1.38Å1.41ÅAromatic
C19C20sing1.38Å1.42ÅAromatic
C17C16doub1.39Å1.41ÅAromatic
C20C15doub1.38Å1.40ÅAromatic
C16C15sing1.39Å1.41ÅAromatic
C16O37sing1.36Å1.41Å
C15C14sing1.51Å1.59Å
O37C38sing1.43Å1.41Å
C14N11sing1.47Å1.30Å
N11C10sing1.47Å1.38Å
N11C12sing1.47Å1.38Å
C10C09sing1.53Å1.55Å
C12C13sing1.53Å1.54Å
C09N08sing1.47Å1.46Å
C13N08sing1.47Å1.47Å
N08C02sing1.40Å1.52Å
C02C01doub1.39Å1.40ÅAromatic
C02C03sing1.39Å1.41ÅAromatic
C01C06sing1.38Å1.40ÅAromatic
F07C03sing1.35Å1.36Å
C03C04doub1.38Å1.40ÅAromatic
C06C05doub1.38Å1.39ÅAromatic
C04C05sing1.38Å1.39ÅAromatic
C01H1sing1.08Å1.08Å
C04H2sing1.08Å1.08Å
C05H3sing1.08Å1.08Å
C06H4sing1.08Å1.08Å
C09H5sing1.09Å1.10Å
C09H6sing1.09Å1.10Å
C10H7sing1.09Å1.10Å
C10H8sing1.09Å1.10Å
C12H10sing1.09Å1.10Å
C12H11sing1.09Å1.10Å
C13H12sing1.09Å1.10Å
C13H13sing1.09Å1.10Å
C14H14sing1.09Å1.10Å
C14H15sing1.09Å1.10Å
C17H16sing1.08Å1.08Å
C18H17sing1.08Å1.08Å
C20H18sing1.08Å1.08Å
C21H19sing1.09Å1.10Å
C24H20sing1.09Å1.10Å
C24H21sing1.09Å1.10Å
C25H22sing1.09Å1.10Å
N26H23sing1.01Å1.00Å
O29H25sing0.97Å0.95Å
N32H26sing0.97Å1.00Å
C33H27sing1.08Å1.08Å
C34H28sing1.08Å1.08Å
C35H29sing1.08Å1.08Å
C36H30sing1.08Å1.08Å
C38H31sing1.09Å1.10Å
C38H32sing1.09Å1.10Å
C38H33sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O28C27O29119.8°120.0°
O28C27C25119.8°120.0°
C35C36C30119.9°116.9°
C36C35C34120.2°122.1°
C36C35H29119.9°118.9°
C35C36H30120.0°121.6°
C36C30C23133.2°132.8°
C36C30C31120.0°121.2°
C30C36H30120.0°121.6°
O29C27C25120.4°120.0°
C27O29H25109.5°117.0°
C27C25C24108.9°109.4°
C27C25N26107.1°109.3°
C27C25H22109.7°109.5°
C35C34C33120.1°122.2°
C35C34H28120.0°118.9°
C34C35H29119.9°119.0°
C25C24C23113.9°108.0°
C24C25N26112.6°109.7°
C25C24H20108.3°109.8°
C25C24H21108.3°109.8°
C24C25H22109.0°109.5°
C24C23C30134.0°129.4°
C24C23C22120.4°123.5°
C23C24H20108.4°109.7°
C23C24H21108.3°109.8°
C25N26C21118.2°111.4°
N26C25H22109.5°109.5°
C25N26H23107.3°110.9°
C23C30C31106.8°106.0°
C30C23C22105.6°107.2°
C30C31C33120.0°120.6°
C30C31N32108.3°107.4°
C23C22N32109.5°109.8°
C23C22C21123.4°123.0°
C34C33C31119.8°116.9°
C34C33H27120.1°121.5°
C33C34H28119.9°118.9°
N26C21C22116.1°108.7°
N26C21C19107.1°109.6°
N26C21H19107.5°109.7°
C21N26H23107.2°110.8°
C33C31N32131.7°132.0°
C31C33H27120.1°121.5°
C31N32C22109.7°109.7°
C31N32H26125.1°125.1°
N32C22C21127.1°127.2°
C22N32H26125.1°125.1°
C22C21C19112.2°109.6°
C22C21H19106.8°109.6°
C21C19C18122.0°120.0°
C21C19C20118.0°120.0°
C19C21H19106.6°109.6°
C19C18C17119.5°120.1°
C18C19C20120.0°120.1°
C19C18H17120.2°119.9°
C18C17C16120.7°119.9°
C18C17H16119.7°120.0°
C17C18H17120.3°120.0°
C19C20C15120.6°120.1°
C19C20H18119.7°119.9°
C17C16C15119.6°120.0°
C17C16O37120.3°120.0°
C16C17H16119.6°120.1°
C20C15C16119.6°119.9°
C20C15C14119.9°120.0°
C15C20H18119.7°120.0°
C15C16O37120.1°120.1°
C16C15C14120.5°120.1°
C16O37C38116.6°117.0°
C15C14N11113.1°109.5°
C15C14H14108.5°109.5°
C15C14H15108.5°109.5°
O37C38H31109.5°109.5°
O37C38H32109.5°109.5°
O37C38H33109.4°109.4°
C14N11C10111.6°111.0°
C14N11C12108.7°111.0°
N11C14H14108.6°109.5°
N11C14H15108.6°109.5°
C10N11C12112.1°110.9°
N11C10C09113.9°109.4°
N11C10H7108.3°109.4°
N11C10H8108.3°109.5°
N11C12C13114.6°109.4°
N11C12H10108.2°109.5°
N11C12H11108.2°109.5°
C10C09N08114.0°109.4°
C10C09H5108.3°109.5°
C10C09H6108.3°109.5°
C09C10H7108.3°109.5°
C09C10H8108.3°109.5°
C12C13N08113.3°109.3°
C13C12H10108.2°109.5°
C13C12H11108.2°109.5°
C12C13H12108.5°109.5°
C12C13H13108.5°109.5°
C09N08C13106.7°110.8°
C09N08C02120.4°111.0°
N08C09H5108.3°109.5°
N08C09H6108.3°109.5°
C13N08C02124.1°111.0°
N08C13H12108.5°109.5°
N08C13H13108.5°109.5°
N08C02C01118.3°120.1°
N08C02C03123.7°120.0°
C01C02C03118.0°119.9°
C02C01C06121.3°119.9°
C02C01H1119.4°120.0°
C02C03F07122.5°120.1°
C02C03C04120.4°119.8°
C01C06C05120.0°120.1°
C06C01H1119.4°120.0°
C01C06H4120.0°120.0°
F07C03C04117.2°120.1°
C03C04C05120.6°120.1°
C03C04H2119.7°119.9°
C06C05C04119.8°120.2°
C06C05H3120.1°119.9°
C05C06H4120.0°119.9°
C05C04H2119.7°120.0°
C04C05H3120.1°119.9°
H5C09H6109.5°109.4°
H7C10H8109.5°109.5°
H10C12H11109.4°109.5°
H12C13H13109.5°109.5°
H14C14H15109.5°109.4°
H20C24H21109.5°109.8°
H31C38H32109.4°109.5°
H31C38H33109.5°109.5°
H32C38H33109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O28C27O29C25179.1°180.0°
O28C27C25C247.3°133.5°
O28C27C25N26129.3°13.4°
O28C27C25H22111.9°106.5°
O28C27O29H250.0°0.0°
C35C36C30H30180.0°179.9°
C36C35C34H29180.0°179.9°
C35C36C30C23179.9°180.0°
C35C36C30C310.0°0.1°
C36C35C34C330.0°0.0°
C36C35C34H28179.9°180.0°
C30C36C35C340.0°0.1°
C36C30C23C240.1°0.2°
C36C30C23C31179.9°179.9°
C36C30C23C22179.5°179.9°
C36C30C31C330.0°0.1°
C36C30C31N32180.0°179.9°
C30C36C35H29180.0°180.0°
O29C27C25C24171.8°46.5°
O29C27C25N2649.7°166.6°
O29C27C25H2269.0°73.5°
C27C25C24N26118.7°119.9°
C27C25C24H22119.7°120.0°
C27C25C24C23163.9°71.1°
C27C25N26H22118.9°119.9°
C27C25N26C21156.6°49.0°
C27C25C24H2043.3°169.4°
C27C25C24H2175.4°48.6°
C27C25N26H2382.2°172.9°
C25C27O29H25179.1°180.0°
C35C34C33H28180.0°180.0°
C35C34C33C310.0°0.0°
C35C34C33H27180.0°180.0°
C34C35C36H30180.0°180.0°
C25C24C23H20120.6°119.6°
C25C24C23H21120.7°119.7°
C24C25N26H22121.4°120.1°
C25C24C23C30152.3°164.3°
C25C24C23C2227.2°15.7°
C24C25N26C2136.9°71.0°
C25C24H20H21118.0°120.8°
C24C25N26H23158.1°52.9°
C23C24C25N2645.3°48.9°
C24C23C30C22179.5°180.0°
C24C23C30C31179.9°179.9°
C24C23C22N32179.4°179.9°
C24C23C22C211.4°0.2°
C23C24H20H21118.0°120.7°
C23C24C25H2276.4°169.0°
C25N26C21H23121.2°124.0°
C25N26C21C229.8°51.3°
C25N26C21C19116.5°171.1°
C25N26C21H19129.3°68.5°
N26C25C24H2075.4°70.7°
N26C25C24H21165.9°168.5°
C23C30C31C33179.9°180.0°
C23C30C31N320.0°0.0°
C30C23C22N320.9°0.1°
C30C23C22C21178.9°179.8°
C30C23C24H2087.1°76.1°
C30C23C24H2131.7°44.6°
C23C30C36H300.1°0.0°
C31C30C23C220.6°0.1°
C30C31C33C340.0°0.0°
C30C31C33N32179.9°180.0°
C30C31N32C220.6°0.0°
C30C31N32H26179.4°180.0°
C30C31C33H27180.0°180.0°
C31C30C36H30180.0°180.0°
C23C22C21N2611.0°16.6°
C23C22N32C311.0°0.1°
C23C22N32C21177.9°179.9°
C23C22C21C19134.6°136.4°
C23C22C21H19108.9°103.2°
C22C23C24H2093.5°103.9°
C22C23C24H21147.8°135.4°
C23C22N32H26179.0°179.9°
C34C33C31H27180.0°179.9°
C34C33C31N32179.9°179.9°
C33C34C35H29180.0°180.0°
N26C21C22N32171.4°163.3°
N26C21C22C19123.7°119.8°
N26C21C22H19119.8°119.8°
N26C21C19H19114.8°120.4°
N26C21C19C18108.3°39.6°
N26C21C19C2071.7°140.6°
C21N26C25H2284.5°168.9°
C33C31N32C22179.5°180.0°
C33C31N32H260.5°0.0°
C31C33C34H28180.0°180.0°
C31N32C22H26180.0°180.0°
C31N32C22C21178.9°179.9°
N32C31C33H270.1°0.0°
N32C22C21C1947.7°43.5°
N32C22C21H1968.8°76.9°
C22C21C19H19116.6°120.4°
C22C21C19C1820.3°79.6°
C22C21C19C20159.7°100.1°
C22C21N26H23131.1°72.7°
C21C22N32H261.1°0.1°
C21C19C18C20180.0°179.7°
C21C19C18C17179.9°180.0°
C21C19C20C15180.0°179.7°
C21C19C18H170.1°0.3°
C21C19C20H180.0°0.3°
C19C21N26H234.8°47.1°
C19C18C17H17180.0°179.8°
C19C18C17C160.3°0.0°
C18C19C20C150.0°0.5°
C19C18C17H16179.7°180.0°
C18C19C20H18180.0°180.0°
C18C19C21H19136.9°160.0°
C17C18C19C200.0°0.3°
C18C17C16H16180.0°179.9°
C18C17C16C150.6°0.0°
C18C17C16O37179.7°180.0°
C19C20C15H18180.0°179.5°
C19C20C15C160.2°0.5°
C19C20C15C14180.0°179.7°
C20C19C18H17179.9°180.0°
C20C19C21H1943.1°20.2°
C17C16C15C200.5°0.3°
C17C16C15O37179.1°180.0°
C17C16C15C14179.7°180.0°
C17C16O37C3849.8°0.0°
C16C17C18H17179.6°179.7°
C20C15C16C14179.8°179.7°
C20C15C16O37179.7°179.7°
C20C15C14N1178.8°104.7°
C20C15C14H14160.6°15.3°
C20C15C14H1541.7°135.2°
C15C16O37C38131.1°180.0°
C16C15C14N11100.9°75.0°
C16C15C14H1419.6°165.0°
C16C15C14H15138.5°45.0°
C15C16C17H16179.4°179.9°
C16C15C20H18179.8°180.0°
O37C16C15C140.6°0.0°
O37C16C17H160.3°0.0°
C16O37C38H31180.0°180.0°
C16O37C38H3260.0°60.0°
C16O37C38H3360.0°60.0°
C15C14N11H14120.5°120.1°
C15C14N11H15120.6°120.0°
C15C14N11C1068.0°170.0°
C15C14N11C12167.8°66.2°
C15C14H14H15118.3°120.0°
C14C15C20H180.0°0.3°
O37C38H31H32120.0°120.0°
O37C38H31H33120.0°120.0°
O37C38H32H33120.0°120.0°
C14N11C10C12122.2°123.9°
C14N11C10C09172.7°176.8°
C14N11C12C13174.9°176.8°
C14N11C10H766.7°63.2°
C14N11C10H852.0°56.8°
C14N11C12H1054.1°63.2°
C14N11C12H1164.4°56.8°
N11C14H14H15118.3°119.9°
N11C10C09H7120.6°119.9°
N11C10C09H8120.6°120.0°
C10N11C12C1351.0°59.3°
N11C10C09N0853.4°58.4°
N11C10C09H567.2°178.4°
N11C10C09H6174.1°61.6°
N11C10H7H8118.0°120.0°
C10N11C12H1069.8°60.7°
C10N11C12H11171.8°179.3°
C10N11C14H1452.5°70.0°
C10N11C14H15171.4°49.9°
C12N11C10C0950.4°59.3°
N11C12C13H10120.7°120.0°
N11C12C13H11120.8°120.0°
N11C12C13N0853.6°58.4°
C12N11C10H7171.1°60.7°
C12N11C10H870.2°179.3°
N11C12H10H11117.7°120.1°
N11C12C13H12174.2°61.6°
N11C12C13H1367.0°178.4°
C12N11C14H1471.6°53.9°
C12N11C14H1547.3°173.8°
C10C09N08H5120.7°120.0°
C10C09N08H6120.6°120.0°
C10C09N08C1351.7°59.3°
C10C09N08C02159.6°176.9°
C10C09H5H6117.9°120.0°
C09C10H7H8118.0°120.1°
C12C13N08C0951.5°59.3°
C12C13N08H12120.6°120.0°
C12C13N08H13120.6°120.0°
C12C13N08C02161.2°176.8°
C13C12H10H11117.7°120.0°
C12C13H12H13118.2°120.0°
C09N08C13C02147.3°123.9°
C09N08C02C0122.3°59.9°
C09N08C02C03157.9°120.0°
N08C09H5H6118.0°120.0°
N08C09C10H7174.1°61.5°
N08C09C10H867.2°178.4°
C09N08C13H12172.1°60.7°
C09N08C13H1369.1°179.2°
C13N08C02C01165.4°63.8°
C13N08C02C0314.7°116.3°
C13N08C09H569.0°179.3°
C13N08C09H6172.3°60.7°
N08C13C12H1067.1°61.6°
N08C13C12H11174.4°178.4°
N08C13H12H13118.3°120.1°
N08C02C01C03179.8°179.9°
N08C02C01C06180.0°179.9°
N08C02C03F070.1°0.0°
N08C02C03C04180.0°179.9°
N08C02C01H10.0°0.3°
C02N08C09H579.8°56.9°
C02N08C09H638.9°63.1°
C02N08C13H1240.6°63.2°
C02N08C13H1378.2°56.9°
C02C01C06H1180.0°179.7°
C01C02C03F07180.0°179.9°
C01C02C03C040.2°0.0°
C02C01C06C050.1°0.0°
C02C01C06H4179.9°179.7°
C03C02C01C060.2°0.0°
C02C03F07C04179.9°180.0°
C02C03C04C050.1°0.0°
C03C02C01H1179.8°179.7°
C02C03C04H2179.9°180.0°
C01C06C05H4180.0°179.7°
C01C06C05C040.1°0.0°
C01C06C05H3179.9°180.0°
F07C03C04C05180.0°179.9°
F07C03C04H20.0°0.0°
C03C04C05C060.1°0.0°
C03C04C05H2180.0°180.0°
C03C04C05H3179.9°180.0°
C06C05C04H3180.0°180.0°
C05C06C01H1179.9°179.7°
C06C05C04H2179.9°180.0°
C04C05C06H4179.9°179.7°
H1C01C06H40.1°0.0°
H2C04C05H30.1°0.0°
H3C05C06H40.1°0.3°
H5C09C10H753.4°58.4°
H5C09C10H8172.1°61.6°
H6C09C10H765.3°178.4°
H6C09C10H853.4°58.4°
H10C12C13H1253.4°178.5°
H10C12C13H13172.3°58.4°
H11C12C13H1265.0°58.4°
H11C12C13H1353.8°61.7°
H16C17C18H170.4°0.2°
H19C21N26H23109.5°167.5°
H20C24C25H22163.0°49.4°
H21C24C25H2244.3°71.4°
H22C25N26H2336.7°67.2°
H27C33C34H280.0°0.0°
H28C34C35H290.1°0.1°
H29C35C36H300.0°0.1°
H31C38H32H33120.0°120.0°

225946

PDB entries from 2024-10-09

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