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5K9

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C22C17sing1.53Å1.59Å
C01C02sing1.53Å1.54Å
C21C17sing1.53Å1.49Å
O18C17sing1.42Å1.42Å
O18C19sing1.36Å1.39Å
C17C11sing1.53Å1.49Å
C02C03sing1.53Å1.55Å
C20C19doub1.39Å1.39ÅAromatic
C20C06sing1.38Å1.39ÅAromatic
C03C04sing1.53Å1.56Å
C19C09sing1.39Å1.41ÅAromatic
C05C04sing1.53Å1.56Å
C05C06sing1.51Å1.50Å
C11C12sing1.53Å1.45Å
C11C10sing1.53Å1.41Å
C06C07doub1.38Å1.44ÅAromatic
C12C13sing1.53Å1.65Å
C09C10sing1.50Å1.45Å
C09C08doub1.39Å1.43ÅAromatic
C10C15sing1.53Å1.49Å
C07C08sing1.39Å1.40ÅAromatic
C08O23sing1.36Å1.41Å
C13C14sing1.53Å1.49Å
C15C14sing1.53Å1.62Å
C14C16sing1.53Å1.60Å
C10H1sing1.09Å1.10Å
C13H132sing1.09Å1.10Å
C13H131sing1.09Å1.10Å
C15H152sing1.09Å1.10Å
C15H151sing1.09Å1.10Å
C20H201sing1.08Å1.08Å
C21H213sing1.09Å1.10Å
C21H211sing1.09Å1.10Å
C21H212sing1.09Å1.10Å
C22H221sing1.09Å1.10Å
C22H223sing1.09Å1.10Å
C22H222sing1.09Å1.10Å
C01H013sing1.09Å1.10Å
C01H011sing1.09Å1.10Å
C01H012sing1.09Å1.10Å
C02H021sing1.09Å1.10Å
C02H022sing1.09Å1.10Å
C03H032sing1.09Å1.10Å
C03H031sing1.09Å1.10Å
C04H042sing1.09Å1.10Å
C04H041sing1.09Å1.10Å
C05H052sing1.09Å1.10Å
C05H051sing1.09Å1.10Å
C07H071sing1.08Å1.08Å
C11H2sing1.09Å1.10Å
C12H121sing1.09Å1.10Å
C12H122sing1.09Å1.10Å
C14H141sing1.09Å1.10Å
C16H163sing1.09Å1.10Å
C16H162sing1.09Å1.10Å
C16H161sing1.09Å1.10Å
O23H231sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C22C17C21106.7°109.7°
C22C17O18108.1°109.4°
C22C17C11117.0°109.8°
C17C22H221109.5°109.5°
C17C22H223109.4°109.5°
C17C22H222109.5°109.5°
C01C02C03115.6°109.5°
C02C01H013109.5°109.5°
C02C01H011109.5°109.5°
C02C01H012109.5°109.5°
C01C02H021107.9°109.4°
C01C02H022107.9°109.5°
C21C17O18105.9°110.0°
C21C17C11106.5°109.7°
C17C21H213109.5°109.5°
C17C21H211109.5°109.5°
C17C21H212109.5°109.5°
C17O18C19120.5°118.9°
O18C17C11112.0°108.2°
O18C19C20117.9°118.4°
O18C19C09119.2°122.1°
C17C11C12120.1°111.7°
C17C11C10119.3°108.2°
C17C11H292.1°109.4°
C02C03C04117.8°109.5°
C03C02H021107.9°109.5°
C03C02H022107.9°109.5°
C02C03H032107.4°109.5°
C02C03H031107.3°109.4°
C19C20C06122.3°120.4°
C20C19C09122.9°119.4°
C19C20H201118.9°119.8°
C20C06C05120.0°119.9°
C20C06C07117.6°120.1°
C06C20H201118.8°119.8°
C03C04C05120.8°109.5°
C04C03H032107.4°109.5°
C04C03H031107.4°109.5°
C03C04H042106.6°109.4°
C03C04H041106.6°109.5°
C19C09C10120.4°120.5°
C19C09C08114.3°120.0°
C04C05C06113.3°109.5°
C05C04H042106.6°109.5°
C05C04H041106.6°109.5°
C04C05H052108.5°109.5°
C04C05H051108.5°109.5°
C05C06C07122.3°120.0°
C06C05H052108.5°109.5°
C06C05H051108.5°109.4°
C12C11C10120.2°108.8°
C11C12C13116.0°108.6°
C12C11H292.1°109.3°
C11C12H121107.8°109.6°
C11C12H122107.8°109.6°
C11C10C09117.5°108.7°
C11C10C15117.9°109.0°
C11C10H1101.0°109.0°
C10C11H292.2°109.4°
C06C07C08118.8°119.9°
C06C07H071120.6°120.0°
C12C13C14113.1°110.2°
C12C13H132108.6°109.4°
C12C13H131108.6°109.2°
C13C12H121107.8°109.6°
C13C12H122107.8°109.6°
C10C09C08125.3°119.5°
C09C10C15114.6°112.1°
C09C10H1100.7°109.0°
C09C08C07124.2°120.2°
C09C08O23116.9°119.9°
C10C15C14122.8°108.6°
C15C10H1100.4°109.1°
C10C15H152106.0°109.6°
C10C15H151106.1°109.6°
C07C08O23118.9°119.9°
C08C07H071120.6°120.1°
C08O23H231109.5°114.0°
C13C14C15104.9°110.2°
C13C14C16107.6°109.4°
C14C13H132108.6°109.4°
C14C13H131108.6°109.4°
C13C14H141109.9°109.3°
C15C14C16117.7°109.4°
C14C15H152106.0°109.6°
C14C15H151106.0°109.6°
C15C14H141108.2°109.4°
C16C14H141108.3°109.2°
C14C16H163109.5°109.5°
C14C16H162109.5°109.4°
C14C16H161109.5°109.5°
H132C13H131109.4°109.3°
H152C15H151109.5°109.8°
H213C21H211109.5°109.4°
H213C21H212109.5°109.5°
H211C21H212109.5°109.4°
H221C22H223109.5°109.5°
H221C22H222109.5°109.4°
H223C22H222109.5°109.5°
H013C01H011109.5°109.4°
H013C01H012109.5°109.5°
H011C01H012109.5°109.5°
H021C02H022109.5°109.4°
H032C03H031109.5°109.4°
H042C04H041109.5°109.5°
H052C05H051109.4°109.5°
H121C12H122109.5°109.8°
H163C16H162109.4°109.5°
H163C16H161109.5°109.5°
H162C16H161109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C22C17C21O18115.0°120.4°
C22C17C21C11125.7°120.7°
C22C17O18C11130.3°119.6°
C22C17O18C19167.5°164.9°
C22C17C11C1225.5°55.9°
C22C17C11C10161.9°175.7°
C22C17C21H213180.0°60.7°
C22C17C21H21160.0°59.3°
C22C17C21H21260.0°179.3°
C17C22H221H223120.0°120.1°
C17C22H221H222120.0°120.0°
C17C22H223H222120.0°120.0°
C22C17C11H268.1°65.2°
C01C02C03H021120.9°120.0°
C01C02C03H022120.9°120.0°
C01C02C03C0467.8°180.0°
C02C01H013H011120.0°120.0°
C02C01H013H012120.0°120.1°
C02C01H011H012120.0°120.0°
C01C02H021H022117.2°120.0°
C01C02C03H032171.0°60.0°
C01C02C03H03153.4°60.0°
C21C17O18C11115.7°119.9°
C21C17O18C1978.5°74.5°
C21C17C11C1293.6°64.7°
C21C17C11C1079.0°55.0°
C17C21H213H211120.0°120.0°
C17C21H213H212120.0°120.0°
C17C21H211H212120.0°120.0°
C21C17C22H221180.0°179.4°
C21C17C22H22360.0°59.3°
C21C17C22H22260.0°60.7°
C21C17C11H2172.7°174.1°
C17O18C19C20160.5°166.9°
C17O18C19C0919.5°13.7°
O18C17C11C12151.1°175.2°
O18C17C11C1036.3°65.0°
O18C17C21H21365.0°178.9°
O18C17C21H211175.0°61.1°
O18C17C21H21255.0°58.9°
O18C17C22H22166.5°58.6°
O18C17C22H22353.5°61.4°
O18C17C22H222173.4°178.5°
O18C17C11H257.5°54.1°
C19O18C17C1137.2°45.4°
O18C19C20C09180.0°179.4°
O18C19C20C06178.8°179.0°
O18C19C09C101.8°1.2°
O18C19C09C08179.8°178.9°
O18C19C20H2011.2°0.9°
C17C11C12C10172.5°119.3°
C17C11C12H293.7°121.2°
C17C11C10H293.7°119.2°
C17C11C12C13173.3°179.1°
C17C11C10C0917.6°52.5°
C17C11C10C15161.3°174.9°
C17C11C10H190.7°66.2°
C11C17C21H21354.3°60.0°
C11C17C21H21165.7°180.0°
C11C17C21H212174.4°60.0°
C11C17C22H22161.0°60.0°
C11C17C22H223179.0°180.0°
C11C17C22H22259.1°60.0°
C17C11C12H12165.7°61.1°
C17C11C12H12252.4°59.4°
C02C03C04H032121.2°120.0°
C02C03C04H031121.2°120.0°
C02C03C04C0513.9°180.0°
C03C02C01H013180.0°60.0°
C03C02C01H01160.0°180.0°
C03C02C01H01260.0°60.0°
C03C02H021H022117.2°120.0°
C02C03H032H031116.2°119.9°
C02C03C04H042107.7°60.0°
C02C03C04H041135.5°60.0°
C19C20C06H201180.0°179.9°
C19C20C06C05178.7°180.0°
C19C20C06C072.4°0.0°
C20C19C09C10178.2°179.4°
C20C19C09C080.2°0.5°
C06C20C19C091.2°0.4°
C20C06C05C0479.0°90.0°
C20C06C05C07176.1°180.0°
C20C06C07C082.7°0.2°
C20C06C05H05241.6°30.0°
C20C06C05H051160.4°150.0°
C20C06C07H071177.3°179.8°
C03C04C05H042121.6°119.9°
C03C04C05H041121.6°120.0°
C03C04C05C06166.0°180.0°
C04C03C02H02153.1°60.0°
C04C03C02H022171.3°60.0°
C04C03H032H031116.2°120.0°
C03C04H042H041114.9°120.0°
C03C04C05H05245.4°60.0°
C03C04C05H05173.5°60.0°
C19C09C10C112.2°22.2°
C19C09C10C08178.2°179.9°
C19C09C10C15142.7°142.7°
C19C09C08C070.6°0.3°
C19C09C08O23179.6°179.6°
C19C09C10H1110.6°96.5°
C09C19C20H201178.8°179.7°
C04C05C06H052120.6°120.0°
C04C05C06H051120.6°120.0°
C04C05C06C0797.1°90.0°
C05C04C03H032135.1°60.0°
C05C04C03H031107.3°60.0°
C05C04H042H041114.9°120.0°
C04C05H052H051118.2°120.0°
C05C06C07C08179.0°179.8°
C05C06C20H2011.3°0.0°
C06C05C04H04272.5°60.0°
C06C05C04H04144.3°60.0°
C06C05H052H051118.2°120.0°
C05C06C07H0711.0°0.2°
C12C11C10H293.7°119.3°
C11C12C13H121120.9°119.7°
C11C12C13H122120.9°119.7°
C12C11C10C09169.8°174.0°
C12C11C10C1526.1°63.6°
C11C12C13C1443.1°59.1°
C12C11C10H181.9°55.3°
C11C12C13H132163.7°61.1°
C11C12C13H13177.4°179.3°
C11C12H121H122117.0°120.5°
C10C11C12C130.8°61.5°
C11C10C09C15144.8°120.5°
C11C10C09H1108.5°118.7°
C11C10C09C08179.6°157.9°
C11C10C15H1108.4°118.8°
C11C10C15C1410.7°61.6°
C11C10C15H152132.5°178.7°
C11C10C15H151111.2°58.1°
C10C11C12H121121.7°58.2°
C10C11C12H122120.2°178.7°
C06C07C08C092.0°0.1°
C06C07C08H071180.0°180.0°
C06C07C08O23178.2°180.0°
C07C06C20H201177.6°179.9°
C07C06C05H052142.3°150.0°
C07C06C05H05123.4°30.0°
C12C13C14H132120.5°120.3°
C12C13C14H131120.6°120.0°
C12C13C14C1552.6°58.3°
C12C13C14C16178.7°61.9°
C12C13H132H131118.4°119.5°
C13C12C11H293.0°57.9°
C13C12H121H122117.0°120.5°
C12C13C14H14163.6°178.6°
C09C10C15H1106.9°120.8°
C10C09C08C07177.7°179.6°
C10C09C08O232.1°0.5°
C09C10C15C14155.4°178.0°
C09C10C15H15282.8°58.3°
C09C10C15H15133.6°62.2°
C09C10C11H276.1°66.6°
C08C09C10C1535.5°37.4°
C09C08C07O23179.8°179.9°
C08C09C10H171.2°83.4°
C09C08C07H071178.1°179.9°
C09C08O23H231180.0°90.0°
C10C15C14C1329.8°59.1°
C10C15C14H152121.8°119.7°
C10C15C14H151121.8°119.7°
C10C15C14C16149.4°61.1°
C10C15H152H151114.0°120.5°
C15C10C11H267.6°55.8°
C10C15C14H14187.5°179.3°
C07C08O23H2310.2°90.0°
O23C08C07H0711.7°0.0°
C13C14C15C16119.6°120.2°
C13C14C15H141117.2°120.2°
C13C14C16H141118.7°119.6°
C14C13H132H131118.3°119.7°
C13C14C15H15292.0°178.8°
C13C14C15H151151.6°60.6°
C14C13C12H12177.8°60.6°
C14C13C12H122164.1°178.9°
C13C14C16H163180.0°60.0°
C13C14C16H16260.0°180.0°
C13C14C16H16160.0°60.0°
C15C14C16H141123.1°119.7°
C14C15C10H197.7°57.3°
C15C14C13H132173.1°61.9°
C15C14C13H13168.0°178.4°
C14C15H152H151114.0°120.4°
C15C14C16H16361.9°60.8°
C15C14C16H162178.1°59.3°
C15C14C16H16158.2°179.2°
C16C14C13H13260.8°177.8°
C16C14C13H13158.1°58.1°
C16C14C15H15227.5°58.6°
C16C14C15H15188.8°179.1°
C14C16H163H162120.0°120.0°
C14C16H163H161120.0°120.0°
C14C16H162H161120.0°120.0°
H1C10C15H15224.1°62.4°
H1C10C15H151140.5°177.0°
H1C10C11H2175.6°174.7°
H132C13C12H12142.7°179.2°
H132C13C12H12275.4°58.6°
H132C13C14H14157.0°58.3°
H131C13C12H121161.6°59.6°
H131C13C12H12243.5°61.0°
H131C13C14H141175.9°61.4°
H152C15C14H141150.7°61.0°
H151C15C14H14134.4°59.6°
H213C21H211H212120.0°120.0°
H221C22H223H222120.0°119.9°
H013C01H011H012120.0°120.0°
H013C01C02H02159.1°179.9°
H013C01C02H02259.1°60.0°
H011C01C02H02160.9°60.0°
H011C01C02H022179.1°59.9°
H012C01C02H021179.1°60.0°
H012C01C02H02260.9°179.9°
H021C02C03H03268.1°180.0°
H021C02C03H031174.3°60.0°
H022C02C03H03250.1°60.0°
H022C02C03H03167.5°180.0°
H032C03C04H04213.5°180.0°
H032C03C04H041103.3°60.0°
H031C03C04H042131.2°60.0°
H031C03C04H04114.3°180.0°
H042C04C05H052166.9°180.0°
H042C04C05H05148.1°59.9°
H041C04C05H05276.2°60.0°
H041C04C05H051164.9°180.0°
H2C11C12H12127.9°177.6°
H2C11C12H122146.0°61.8°
H141C14C16H16361.2°179.6°
H141C14C16H16258.7°60.4°
H141C14C16H161178.7°59.6°
H163C16H162H161120.0°120.0°

225158

PDB entries from 2024-09-18

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