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YQR

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C29N28sing1.46Å1.45Å
N30N28sing1.40Å1.31ÅAromatic
N30C31doub1.30Å1.31ÅAromatic
N28C27sing1.35Å1.33ÅAromatic
C27C26doub1.38Å1.39ÅAromatic
C31C26sing1.41Å1.39ÅAromatic
C26C25sing1.48Å1.50Å
O23C22doub1.22Å1.26Å
C22C21sing1.46Å1.49Å
C22O24sing1.35Å1.26Å
C25C21doub1.38Å1.39ÅAromatic
C25C18sing1.47Å1.41ÅAromatic
C21N20sing1.38Å1.32ÅAromatic
C18C17doub1.40Å1.40ÅAromatic
C18C19sing1.41Å1.40ÅAromatic
C17C16sing1.37Å1.38ÅAromatic
N20C19sing1.37Å1.35ÅAromatic
C19C14doub1.39Å1.41ÅAromatic
C16C15doub1.39Å1.41ÅAromatic
O13C12doub1.22Å1.19Å
C14C15sing1.38Å1.39ÅAromatic
C14C02sing1.51Å1.56Å
C12O11sing1.34Å1.38Å
C12N03sing1.34Å1.41Å
O11C05sing1.45Å1.42Å
C06C05sing1.53Å1.50Å
C06C07sing1.54Å1.52Å
N03C02sing1.46Å1.46Å
N03C04sing1.47Å1.44Å
C02C01sing1.53Å1.50Å
C05C04sing1.53Å1.48Å
C05C10sing1.53Å1.51Å
C07C10sing1.54Å1.50Å
C07C08sing1.53Å1.48Å
N09C08sing1.47Å1.45Å
C17H171sing1.08Å1.08Å
C16H161sing1.08Å1.08Å
C15H151sing1.08Å1.08Å
C10H101sing1.09Å1.10Å
C10H102sing1.09Å1.10Å
C01H011sing1.09Å1.10Å
C01H013sing1.09Å1.10Å
C01H012sing1.09Å1.10Å
C02H021sing1.09Å1.10Å
C04H041sing1.09Å1.10Å
C04H042sing1.09Å1.10Å
C06H061sing1.09Å1.10Å
C06H062sing1.09Å1.10Å
C07H071sing1.09Å1.10Å
C08H082sing1.09Å1.10Å
C08H081sing1.09Å1.10Å
C27H271sing1.08Å1.08Å
C29H291sing1.09Å1.10Å
C29H292sing1.09Å1.10Å
C29H293sing1.09Å1.10Å
C31H311sing1.08Å1.08Å
N09H091sing1.01Å1.00Å
N09H1sing1.01Å1.00Å
N20H201sing0.97Å1.00Å
O24H2sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C29N28N30121.5°125.9°
C29N28C27127.3°125.8°
N28C29H291109.5°109.5°
N28C29H292109.5°109.4°
N28C29H293109.5°109.5°
N28N30C31108.8°108.9°
N30N28C27111.1°108.3°
N30C31C26108.6°108.1°
N30C31H311125.7°126.0°
N28C27C26106.3°107.5°
N28C27H271126.9°126.3°
C27C26C31105.2°107.3°
C27C26C25129.5°126.4°
C26C27H271126.8°126.3°
C31C26C25125.4°126.4°
C26C31H311125.7°125.9°
C26C25C21128.2°126.7°
C26C25C18126.5°126.8°
O23C22C21117.6°120.0°
O23C22O24122.2°120.0°
C21C22O24119.4°120.0°
C22C21C25129.7°125.6°
C22C21N20120.0°125.5°
C22O24H2109.5°114.0°
C21C25C18105.2°106.5°
C25C21N20110.3°108.9°
C25C18C17133.5°133.6°
C25C18C19107.2°106.5°
C21N20C19109.7°110.0°
C21N20H201125.1°124.9°
C17C18C19119.3°119.9°
C18C17C16118.5°119.9°
C18C17H171120.8°120.1°
C18C19N20107.5°108.0°
C18C19C14122.3°119.2°
C17C16C15121.9°120.5°
C16C17H171120.7°120.1°
C17C16H161119.1°119.7°
N20C19C14130.1°132.7°
C19N20H201125.1°125.0°
C19C14C15117.5°119.8°
C19C14C02119.4°120.1°
C16C15C14120.5°120.7°
C15C16H161119.0°119.8°
C16C15H151119.7°119.7°
O13C12O11124.1°123.0°
O13C12N03128.2°123.1°
C15C14C02123.1°120.1°
C14C15H151119.8°119.6°
C14C02N03106.6°109.5°
C14C02C01114.3°109.4°
C14C02H021107.9°109.4°
O11C12N03107.7°113.8°
C12O11C05110.9°108.9°
C12N03C02121.2°125.6°
C12N03C04108.8°108.8°
O11C05C06114.6°116.2°
O11C05C04104.8°105.1°
O11C05C10112.2°116.2°
C05C06C0788.5°86.8°
C06C05C04119.3°115.7°
C06C05C1090.6°88.1°
C05C06H061114.4°113.7°
C05C06H062114.4°113.6°
C06C07C1090.1°87.2°
C06C07C08115.1°113.6°
C07C06H061114.4°113.7°
C07C06H062114.4°113.6°
C06C07H071110.0°113.6°
C02N03C04128.5°125.6°
N03C02C01110.3°109.5°
N03C02H021109.1°109.5°
N03C04C05105.4°103.3°
N03C04H041110.5°110.6°
N03C04H042110.4°110.7°
C02C01H011109.5°109.5°
C02C01H013109.5°109.5°
C02C01H012109.5°109.4°
C01C02H021108.5°109.4°
C04C05C10115.3°115.7°
C05C04H041110.5°110.6°
C05C04H042110.5°110.7°
C05C10C0789.1°86.9°
C05C10H101114.3°113.6°
C05C10H102114.3°113.7°
C10C07C08119.1°113.6°
C07C10H101114.3°113.7°
C07C10H102114.3°113.7°
C10C07H071110.3°113.6°
C07C08N09111.0°109.5°
C08C07H071110.5°112.9°
C07C08H082109.1°109.4°
C07C08H081109.1°109.5°
N09C08H082109.1°109.5°
N09C08H081109.1°109.5°
C08N09H091109.5°111.0°
C08N09H1109.4°111.0°
H101C10H102109.5°112.9°
H011C01H013109.4°109.5°
H011C01H012109.5°109.4°
H013C01H012109.4°109.4°
H041C04H042109.5°110.6°
H061C06H062109.5°113.0°
H082C08H081109.5°109.4°
H291C29H292109.4°109.4°
H291C29H293109.5°109.5°
H292C29H293109.5°109.5°
H091N09H1109.5°111.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C29N28N30C27178.9°179.8°
C29N28N30C31179.4°179.8°
C29N28C27C26179.9°179.9°
C29N28C27H2710.1°0.1°
N28C29H291H292120.0°120.0°
N28C29H291H293120.0°120.1°
N28C29H292H293120.0°120.0°
N30N28C27C261.1°0.2°
N28N30C31C261.6°0.1°
N30N28C27H271178.9°179.8°
N30N28C29H2910.0°89.7°
N30N28C29H292120.0°30.2°
N30N28C29H293120.0°150.2°
N28N30C31H311178.4°179.8°
C31N30N28C271.7°0.0°
N30C31C26C270.9°0.2°
N30C31C26H311180.0°179.9°
N30C31C26C25178.5°180.0°
N28C27C26H271180.0°180.0°
N28C27C26C310.1°0.2°
N28C27C26C25179.5°180.0°
C27N28C29H291178.6°90.0°
C27N28C29H29258.7°150.0°
C27N28C29H29361.3°30.0°
C27C26C31C25179.4°179.8°
C27C26C25C2141.4°64.9°
C27C26C25C18138.4°115.3°
C27C26C31H311179.1°179.7°
C31C26C25C21137.9°115.3°
C31C26C25C1842.3°64.5°
C31C26C27H271179.8°179.8°
C26C25C21C225.1°0.3°
C26C25C21C18179.8°179.9°
C26C25C21N20178.3°180.0°
C26C25C18C170.1°0.1°
C26C25C18C19179.8°179.8°
C25C26C27H2710.5°0.0°
C25C26C31H3111.5°0.1°
O23C22C21O24170.0°180.0°
O23C22C21C2535.4°0.3°
O23C22C21N20140.9°180.0°
O23C22O24H20.0°0.0°
C22C21C25N20176.6°179.7°
C22C21C25C18175.1°179.9°
C22C21N20C19174.6°180.0°
C22C21N20H2015.4°0.2°
C21C22O24H2169.5°180.0°
O24C22C21C25154.6°179.7°
O24C22C21N2029.1°0.0°
C21C25C18C17179.9°180.0°
C21C25C18C190.1°0.1°
C25C21N20C192.4°0.3°
C25C21N20H201177.6°179.9°
C18C25C21N201.5°0.1°
C25C18C17C19179.8°179.9°
C25C18C17C16178.3°180.0°
C25C18C19N201.3°0.3°
C25C18C19C14178.7°180.0°
C25C18C17H1711.7°0.1°
C21N20C19C182.3°0.3°
C21N20C19H201180.0°179.8°
C21N20C19C14177.7°180.0°
C18C17C16H171180.0°179.9°
C17C18C19N20178.6°179.8°
C17C18C19C141.5°0.1°
C18C17C16C151.0°0.0°
C18C17C16H161179.0°179.9°
C19C18C17C161.9°0.1°
C18C19N20C14180.0°179.6°
C18C19C14C150.1°0.1°
C18C19C14C02178.8°180.0°
C19C18C17H171178.1°179.8°
C18C19N20H201177.7°179.9°
C17C16C15H161180.0°180.0°
C17C16C15C140.4°0.1°
C17C16C15H151179.6°180.0°
N20C19C14C15179.9°179.7°
N20C19C14C021.1°0.4°
C19C14C15C160.8°0.0°
C19C14C15C02178.9°179.9°
C19C14C02N0395.7°75.9°
C19C14C02C01142.1°164.0°
C19C14C15H151179.2°179.9°
C19C14C02H02121.4°44.1°
C14C19N20H2012.3°0.2°
C16C15C14H151180.0°179.9°
C16C15C14C02179.7°179.9°
C15C16C17H171179.0°179.9°
O13C12O11N03177.5°180.0°
O13C12O11C05178.9°179.9°
O13C12N03C023.6°0.0°
O13C12N03C04170.7°180.0°
C15C14C02N0383.2°104.0°
C15C14C02C0139.0°16.0°
C14C15C16H161179.6°179.9°
C15C14C02H021159.8°135.9°
C14C02N03C1283.3°58.2°
C14C02N03C01124.7°120.0°
C14C02N03H021116.2°120.0°
C14C02N03C0481.1°121.7°
C14C02C01H021120.4°119.9°
C02C14C15H1510.3°0.0°
C14C02C01H011180.0°60.1°
C14C02C01H01360.0°60.0°
C14C02C01H01260.0°180.0°
C12O11C05C06144.6°129.2°
O11C12N03C02173.8°180.0°
O11C12N03C046.7°0.0°
C12O11C05C0411.9°0.0°
C12O11C05C10113.9°129.2°
N03C12O11C053.6°0.0°
C12N03C02C04164.4°180.0°
C12N03C02C01152.1°61.8°
C12N03C04C0513.7°0.0°
C12N03C02H02133.0°178.2°
C12N03C04H041105.6°118.4°
C12N03C04H042133.1°118.5°
O11C05C06C04125.4°123.9°
O11C05C06C10114.8°118.4°
O11C05C06C07105.1°93.6°
O11C05C04N0315.3°0.0°
O11C05C04C10123.8°129.6°
O11C05C10C07107.2°93.5°
O11C05C10H101136.4°152.0°
O11C05C10H1029.2°21.1°
O11C05C04H041104.1°118.5°
O11C05C04H042134.6°118.6°
O11C05C06H06111.2°20.9°
O11C05C06H062138.6°152.0°
C05C06C07H061116.3°114.5°
C05C06C07H062116.3°114.4°
C06C05C04N03145.3°129.5°
C06C05C04C10106.2°100.9°
C05C06C07C109.8°24.7°
C05C06C07C08132.3°139.3°
C06C05C10H101106.5°89.6°
C06C05C10H102126.3°139.5°
C06C05C04H04125.9°112.0°
C06C05C04H04295.4°10.9°
C05C06H061H062130.0°131.4°
C05C06C07H071102.0°89.9°
C07C06C05C04129.5°142.6°
C06C07C10C08119.1°114.6°
C06C07C10H071111.4°114.6°
C06C07C08H071125.4°131.2°
C06C07C08N0986.1°175.0°
C06C07C10H101106.7°89.8°
C06C07C10H102126.1°139.2°
C07C06H061H062129.9°131.4°
C06C07C08H08234.1°55.0°
C06C07C08H081153.6°65.0°
N03C02C01H021119.5°120.0°
C02N03C04C05179.6°180.0°
N03C02C01H01159.9°60.0°
N03C02C01H01360.1°179.9°
N03C02C01H012179.9°60.0°
C02N03C04H04160.3°61.5°
C02N03C04H04261.0°61.5°
C04N03C02C0143.6°118.3°
N03C04C05H041119.3°118.4°
N03C04C05H042119.3°118.6°
N03C04C05C10108.5°129.6°
C04N03C02H021162.7°1.8°
N03C04H041H042121.9°123.1°
C02C01H011H013120.0°120.1°
C02C01H011H012120.0°119.9°
C02C01H013H012120.0°120.0°
C04C05C10C07133.0°142.6°
C04C05C10H10116.6°28.1°
C04C05C10H102110.6°102.9°
C05C04H041H042121.9°123.0°
C04C05C06H061114.2°102.9°
C04C05C06H06213.2°28.1°
C05C10C07H101116.4°114.5°
C05C10C07H102116.4°114.5°
C05C10C07C08128.9°139.3°
C05C10H101H102129.6°131.3°
C10C05C04H041132.1°11.1°
C10C05C04H04210.8°111.9°
C10C05C06H061126.0°139.4°
C10C05C06H062106.5°89.6°
C05C10C07H071101.7°89.9°
C10C07C08H071129.3°131.2°
C10C07C08N09168.6°87.4°
C07C10H101H102129.7°131.4°
C10C07C06H061126.0°139.2°
C10C07C06H062106.5°89.7°
C10C07C08H08271.2°152.6°
C10C07C08H08148.4°32.7°
C07C08N09H082120.2°120.0°
C07C08N09H081120.2°120.1°
C08C07C10H10112.5°24.8°
C08C07C10H102114.8°106.2°
C08C07C06H061111.4°106.2°
C08C07C06H06216.1°24.8°
C07C08H082H081119.3°120.0°
C07C08N09H091180.0°180.0°
C07C08N09H160.0°56.1°
N09C08C07H07139.3°43.8°
N09C08H082H081119.3°120.0°
C08N09H091H1120.0°123.9°
H171C17C16H1611.0°0.0°
H161C16C15H1510.4°0.0°
H101C10C07H071141.9°155.6°
H102C10C07H07114.7°24.6°
H011C01H013H012120.0°120.0°
H011C01C02H02159.6°180.0°
H013C01C02H021179.6°59.9°
H012C01C02H02160.4°60.1°
H061C06C07H07114.3°24.6°
H062C06C07H071141.8°155.7°
H071C07C08H082159.5°76.2°
H071C07C08H08180.9°163.8°
H082C08N09H09159.8°60.0°
H082C08N09H1179.8°176.0°
H081C08N09H09159.7°59.9°
H081C08N09H160.2°64.0°
H291C29H292H293120.0°120.0°

224931

PDB entries from 2024-09-11

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