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D56

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1C2sing1.47Å1.47Å
N1C6sing1.47Å1.47Å
N1C7sing1.43Å1.43Å
C2C3sing1.52Å1.52Å
C3C4sing1.52Å1.52Å
C4C5sing1.52Å1.52Å
C5C6sing1.52Å1.52Å
C7C8sing1.39Å1.39ÅAromatic
C7C31doub1.39Å1.39ÅAromatic
C8C9doub1.39Å1.39ÅAromatic
C9CLsing1.73Å1.73Å
C9C11sing1.40Å1.40ÅAromatic
C11C12doub1.39Å1.39ÅAromatic
C11O12sing1.37Å1.37Å
C12N13sing1.41Å1.41Å
C12C31sing1.39Å1.39ÅAromatic
N13C14sing1.34Å1.34Å
C14O15doub1.21Å1.21Å
C14C16sing1.49Å1.49Å
C16C17sing1.39Å1.39ÅAromatic
C16C30doub1.39Å1.39ÅAromatic
C17C18doub1.39Å1.39ÅAromatic
C18C19sing1.51Å1.51Å
C18C20sing1.40Å1.40ÅAromatic
C10C13sing1.50Å1.50Å
C20O21sing1.37Å1.37Å
C20C28doub1.41Å1.41ÅAromatic
O21C22sing1.44Å1.44Å
C22C23sing1.52Å1.52Å
C23N24sing1.49Å1.49Å
C28C29sing1.51Å1.51Å
C28C30sing1.39Å1.39ÅAromatic
O12C13sing1.46Å1.46Å
C2H2C1sing1.10Å1.10Å
C2H2C2sing1.10Å1.10Å
C6H6C1sing1.10Å1.10Å
C6H6C2sing1.10Å1.10Å
C3H3C1sing1.10Å1.10Å
C3H3C2sing1.10Å1.10Å
C4H4C1sing1.10Å1.10Å
C4H4C2sing1.10Å1.10Å
C5H5C1sing1.10Å1.10Å
C5H5C2sing1.10Å1.10Å
C8H8sing1.08Å1.08Å
C31H31sing1.08Å1.08Å
N13H13sing1.00Å1.00Å
C17H17sing1.08Å1.08Å
C30H30sing1.08Å1.08Å
C19H191sing1.10Å1.10Å
C19H192sing1.10Å1.10Å
C19H193sing1.10Å1.10Å
C10H101sing1.10Å1.10Å
C10H102sing1.10Å1.10Å
C10H103sing1.10Å1.10Å
C13H131sing1.10Å1.10Å
C13H132sing1.10Å1.10Å
C22H221sing1.10Å1.10Å
C22H222sing1.10Å1.10Å
C23H231sing1.10Å1.10Å
C23H232sing1.10Å1.10Å
N24H241sing1.00Å1.00Å
N24H242sing1.00Å1.00Å
C29H291sing1.10Å1.10Å
C29H292sing1.10Å1.10Å
C29H293sing1.10Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2N1C6109.5°109.5°
C2N1C7119.6°119.6°
N1C2C3110.5°110.5°
N1C2H2C1109.1°109.1°
N1C2H2C2108.9°108.9°
C6N1C7115.4°115.4°
N1C6C5110.7°110.7°
N1C6H6C1109.1°109.1°
N1C6H6C2108.8°108.8°
N1C7C8120.7°120.7°
N1C7C31120.4°120.4°
C2C3C4111.0°111.0°
C3C2H2C1109.1°109.1°
C3C2H2C2108.9°108.9°
C2C3H3C1108.9°108.9°
C2C3H3C2108.6°108.6°
C3C4C5110.8°110.8°
C4C3H3C1109.0°109.0°
C4C3H3C2108.6°108.6°
C3C4H4C1109.0°109.0°
C3C4H4C2108.7°108.7°
C4C5C6111.0°111.0°
C5C4H4C1109.0°109.0°
C5C4H4C2108.7°108.7°
C4C5H5C1108.9°109.0°
C4C5H5C2108.6°108.6°
C5C6H6C1109.0°109.0°
C5C6H6C2108.8°108.8°
C6C5H5C1109.0°109.0°
C6C5H5C2108.6°108.6°
C8C7C31118.8°118.8°
C7C8C9120.6°120.6°
C7C8H8119.7°119.7°
C7C31C12121.5°121.5°
C7C31H31119.3°119.3°
C8C9CL119.5°119.5°
C8C9C11120.2°120.2°
C9C8H8119.7°119.7°
CLC9C11120.3°120.3°
C9C11C12119.5°119.5°
C9C11O12122.2°122.2°
C12C11O12118.2°118.2°
C11C12N13117.8°117.8°
C11C12C31119.4°119.4°
C11O12C13116.8°116.8°
N13C12C31122.7°122.7°
C12N13C14128.0°128.0°
C12N13H13116.0°116.0°
C12C31H31119.3°119.3°
N13C14O15123.1°123.1°
N13C14C16115.5°115.5°
C14N13H13116.0°116.0°
O15C14C16121.5°121.5°
C14C16C17118.9°118.9°
C14C16C30121.1°121.1°
C17C16C30120.0°120.0°
C16C17C18121.1°121.1°
C16C17H17119.5°119.5°
C16C30C28120.5°120.5°
C16C30H30119.8°119.8°
C17C18C19120.7°120.7°
C17C18C20118.5°118.5°
C18C17H17119.5°119.5°
C19C18C20120.8°120.8°
C18C19H191109.5°109.5°
C18C19H192109.5°109.5°
C18C19H193109.5°109.5°
C18C20O21118.9°118.9°
C18C20C28121.0°121.0°
C10C13O12110.3°110.3°
C13C10H101109.5°109.5°
C13C10H102109.5°109.5°
C13C10H103109.4°109.4°
C10C13H131109.2°109.2°
C10C13H132109.0°109.0°
O21C20C28120.1°120.1°
C20O21C22117.3°117.3°
C20C28C29120.7°120.7°
C20C28C30118.9°118.9°
O21C22C23108.0°108.0°
O21C22H221110.0°110.0°
O21C22H222110.3°110.3°
C22C23N24110.5°110.5°
C23C22H221110.0°110.0°
C23C22H222110.3°110.3°
C22C23H231109.1°109.1°
C22C23H232108.9°108.9°
N24C23H231109.1°109.1°
N24C23H232108.9°108.9°
C23N24H241109.5°109.5°
C23N24H242109.4°109.4°
C29C28C30120.4°120.4°
C28C29H291109.5°109.5°
C28C29H292109.4°109.4°
C28C29H293109.5°109.5°
C28C30H30119.7°119.7°
O12C13H131109.2°109.2°
O12C13H132109.0°109.0°
H2C1C2H2C2110.3°110.3°
H6C1C6H6C2110.4°110.4°
H3C1C3H3C2110.7°110.7°
H4C1C4H4C2110.5°110.5°
H5C1C5H5C2110.7°110.7°
H191C19H192109.5°109.5°
H191C19H193109.5°109.5°
H192C19H193109.5°109.5°
H101C10H102109.4°109.4°
H101C10H103109.5°109.5°
H102C10H103109.5°109.5°
H131C13H132110.1°110.1°
H221C22H222108.3°108.3°
H231C23H232110.3°110.3°
H241N24H242109.5°109.5°
H291C29H292109.4°109.5°
H291C29H293109.4°109.5°
H292C29H293109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2N1C6C7138.4°138.4°
N1C2C3H2C1120.0°120.0°
N1C2C3H2C2119.6°119.6°
N1C2C3C457.2°57.2°
C2N1C6C562.0°62.0°
C2N1C7C842.3°42.3°
C2N1C7C31139.7°139.7°
N1C2H2C1H2C2119.6°119.6°
C2N1C6H6C1178.0°178.0°
C2N1C6H6C257.5°57.5°
N1C2C3H3C1177.3°177.3°
N1C2C3H3C262.1°62.1°
C6N1C2C362.1°62.1°
N1C6C5C456.9°56.9°
N1C6C5H6C1120.0°120.0°
N1C6C5H6C2119.5°119.5°
C6N1C7C891.8°91.8°
C6N1C7C3186.3°86.3°
C6N1C2H2C157.9°57.9°
C6N1C2H2C2178.4°178.4°
N1C6H6C1H6C2119.5°119.5°
N1C6C5H5C1176.9°176.9°
N1C6C5H5C262.4°62.4°
C7N1C2C3161.5°161.5°
C7N1C6C5159.6°159.6°
N1C7C8C31178.1°178.1°
N1C7C8C9178.9°178.9°
N1C7C31C12179.2°179.2°
C7N1C2H2C178.5°78.6°
C7N1C2H2C241.9°41.9°
C7N1C6H6C139.6°39.6°
C7N1C6H6C280.9°80.9°
N1C7C8H81.1°1.1°
N1C7C31H310.8°0.8°
C2C3C4H3C1120.0°120.0°
C2C3C4H3C2119.4°119.4°
C2C3C4C551.7°51.7°
C3C2H2C1H2C2119.6°119.6°
C2C3H3C1H3C2119.4°119.4°
C2C3C4H4C168.3°68.3°
C2C3C4H4C2171.2°171.2°
C3C4C5H4C1120.0°120.0°
C3C4C5H4C2119.5°119.5°
C3C4C5C651.5°51.5°
C4C3C2H2C162.7°62.7°
C4C3C2H2C2176.8°176.8°
C4C3H3C1H3C2119.4°119.4°
C3C4H4C1H4C2119.4°119.4°
C3C4C5H5C1171.5°171.5°
C3C4C5H5C267.9°67.9°
C4C5C6H5C1120.0°120.0°
C4C5C6H5C2119.3°119.3°
C4C5C6H6C1176.9°176.9°
C4C5C6H6C262.6°62.6°
C5C4C3H3C1171.7°171.7°
C5C4C3H3C267.7°67.7°
C5C4H4C1H4C2119.4°119.4°
C4C5H5C1H5C2119.3°119.4°
C5C6H6C1H6C2119.5°119.5°
C6C5C4H4C168.5°68.5°
C6C5C4H4C2171.0°171.0°
C6C5H5C1H5C2119.4°119.4°
C7C8C9H8180.0°180.0°
C7C8C9CL179.6°179.6°
C7C8C9C111.0°1.0°
C8C7C31C121.1°1.1°
C8C7C31H31178.9°178.9°
C31C7C8C90.8°0.8°
C7C31C12C111.6°1.6°
C7C31C12N13179.3°179.3°
C7C31C12H31180.0°180.0°
C31C7C8H8179.2°179.2°
C8C9CLC11178.6°178.6°
C8C9C11C121.5°1.5°
C8C9C11O12178.1°178.1°
CLC9C11C12179.9°179.9°
CLC9C11O123.4°3.4°
CLC9C8H80.4°0.4°
C9C11C12O12176.7°176.7°
C9C11C12N13179.6°179.6°
C9C11C12C311.8°1.8°
C9C11O12C1397.0°97.0°
C11C9C8H8179.0°179.0°
C11C12N13C31177.7°177.7°
C11C12N13C14149.5°149.5°
C12C11O12C1379.7°79.7°
C11C12C31H31178.4°178.4°
C11C12N13H1330.5°30.5°
O12C11C12N133.7°3.7°
O12C11C12C31178.5°178.5°
C11O12C13C10165.3°165.3°
C11O12C13H13145.3°45.3°
C11O12C13H13275.1°75.1°
C12N13C14H13180.0°180.0°
C12N13C14O1516.8°16.8°
C12N13C14C16161.8°161.8°
N13C12C31H310.7°0.7°
C31C12N13C1432.8°32.8°
C31C12N13H13147.3°147.3°
N13C14O15C16178.5°178.5°
N13C14C16C1750.1°50.1°
N13C14C16C30131.0°131.0°
O15C14C16C17128.5°128.5°
O15C14C16C3050.4°50.4°
O15C14N13H13163.2°163.2°
C14C16C17C30178.9°178.9°
C14C16C17C18178.7°178.7°
C14C16C30C28178.9°178.9°
C16C14N13H1318.2°18.2°
C14C16C17H171.3°1.3°
C14C16C30H301.1°1.1°
C16C17C18H17180.0°180.0°
C16C17C18C19179.9°179.9°
C16C17C18C200.1°0.1°
C17C16C30C280.0°0.0°
C17C16C30H30180.0°180.0°
C30C16C17C180.2°0.2°
C16C30C28C200.3°0.3°
C16C30C28C29179.6°179.6°
C16C30C28H30180.0°180.0°
C30C16C17H17179.8°179.8°
C17C18C19C20180.0°180.0°
C17C18C20O21178.7°178.7°
C17C18C20C280.2°0.2°
C17C18C19H191126.5°126.5°
C17C18C19H192113.5°113.5°
C17C18C19H1936.5°6.5°
C19C18C20O211.3°1.3°
C19C18C20C28179.8°179.8°
C19C18C17H170.1°0.1°
C18C19H191H192120.0°120.0°
C18C19H191H193120.0°120.0°
C18C19H192H193120.0°120.0°
C18C20O21C28178.6°178.6°
C18C20O21C2279.0°79.0°
C18C20C28C29179.5°179.5°
C18C20C28C300.4°0.4°
C20C18C17H17179.9°179.9°
C20C18C19H19153.5°53.5°
C20C18C19H19266.5°66.5°
C20C18C19H193173.5°173.5°
C10C13O12H131120.0°120.0°
C10C13O12H132119.7°119.7°
C13C10H101H102120.0°120.0°
C13C10H101H103120.0°120.0°
C13C10H102H103120.0°120.0°
C10C13H131H132119.7°119.7°
C20O21C22C23143.8°143.8°
O21C20C28C291.0°1.0°
O21C20C28C30178.9°178.9°
C20O21C22H22196.2°96.2°
C20O21C22H22223.2°23.2°
C28C20O21C2299.5°99.5°
C20C28C29C30179.9°179.9°
C20C28C30H30179.7°179.7°
C20C28C29H291103.8°103.8°
C20C28C29H292136.2°136.2°
C20C28C29H29316.2°16.2°
O21C22C23H221120.0°120.0°
O21C22C23H222120.6°120.6°
O21C22C23N24106.8°106.8°
O21C22H221H222120.6°120.6°
O21C22C23H231133.2°133.2°
O21C22C23H23212.8°12.8°
C22C23N24H231120.0°120.0°
C22C23N24H232119.5°119.6°
C23C22H221H222120.6°120.6°
C22C23H231H232119.6°119.5°
C22C23N24H24186.1°86.1°
C22C23N24H24233.8°33.8°
N24C23C22H22113.2°13.2°
N24C23C22H222132.7°132.7°
N24C23H231H232119.6°119.6°
C23N24H241H242120.0°120.0°
C29C28C30H300.4°0.4°
C28C29H291H292120.0°120.0°
C28C29H291H293120.0°120.0°
C28C29H292H293120.0°120.0°
C30C28C29H29176.3°76.3°
C30C28C29H29243.7°43.7°
C30C28C29H293163.7°163.7°
O12C13C10H101138.2°138.2°
O12C13C10H102101.8°101.8°
O12C13C10H10318.2°18.2°
O12C13H131H132119.7°119.7°
H2C1C2C3H3C157.3°57.3°
H2C1C2C3H3C2177.9°177.9°
H2C2C2C3H3C163.2°63.2°
H2C2C2C3H3C257.4°57.4°
H6C1C6C5H5C163.1°63.1°
H6C1C6C5H5C257.6°57.6°
H6C2C6C5H5C157.4°57.4°
H6C2C6C5H5C2178.1°178.1°
H3C1C3C4H4C151.7°51.7°
H3C1C3C4H4C268.9°68.9°
H3C2C3C4H4C1172.3°172.3°
H3C2C3C4H4C251.8°51.8°
H4C1C4C5H5C151.5°51.5°
H4C1C4C5H5C2172.1°172.1°
H4C2C4C5H5C169.1°69.0°
H4C2C4C5H5C251.6°51.6°
H191C19H192H193120.0°120.0°
H101C10H102H103120.0°120.0°
H101C10C13H131101.7°101.7°
H101C10C13H13218.6°18.6°
H102C10C13H13118.2°18.2°
H102C10C13H132138.5°138.5°
H103C10C13H131138.3°138.3°
H103C10C13H132101.4°101.4°
H221C22C23H231106.7°106.7°
H221C22C23H232132.8°132.9°
H222C22C23H23112.7°12.7°
H222C22C23H232107.8°107.7°
H231C23N24H241153.9°153.9°
H231C23N24H24286.2°86.2°
H232C23N24H24133.4°33.4°
H232C23N24H242153.4°153.4°
H291C29H292H293119.9°120.0°

220113

PDB entries from 2024-05-22

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