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8RN

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C21C14sing1.53Å1.53Å
C14C13sing1.53Å1.55Å
C14C15sing1.51Å1.51Å
C13C12sing1.51Å1.55Å
C16C15doub1.38Å1.38ÅAromatic
C16C17sing1.38Å1.36ÅAromatic
C15C20sing1.38Å1.39ÅAromatic
C17C18doub1.38Å1.37ÅAromatic
C20C19doub1.38Å1.37ÅAromatic
C12O2doub1.21Å1.23Å
C12N2sing1.35Å1.36Å
C18C19sing1.38Å1.38ÅAromatic
C9N2sing1.47Å1.50Å
C9C8sing1.53Å1.52Å
N2C10sing1.47Å1.49Å
C8C7sing1.53Å1.55Å
OC3doub1.22Å1.20Å
SC4sing1.76Å1.65ÅAromatic
SCsing1.76Å1.62ÅAromatic
C10C11sing1.53Å1.54Å
C3Csing1.42Å1.45Å
C3N1sing1.35Å1.39Å
C7C11sing1.54Å1.53Å
C7C6sing1.53Å1.52Å
C7O1sing1.43Å1.46Å
C4C5doub1.33Å1.40ÅAromatic
CC1doub1.39Å1.37ÅAromatic
C6N1sing1.47Å1.47Å
N1C2sing1.36Å1.39Å
C5C1sing1.40Å1.40ÅAromatic
C5BRsing1.89Å1.91Å
C1Nsing1.37Å1.46Å
C2Ndoub1.30Å1.31Å
C13H1sing1.09Å1.10Å
C13H2sing1.09Å1.10Å
C14H3sing1.09Å1.10Å
C21H4sing1.09Å1.10Å
C21H5sing1.09Å1.10Å
C21H6sing1.09Å1.10Å
C20H7sing1.08Å1.08Å
C19H8sing1.08Å1.08Å
C18H9sing1.08Å1.08Å
C17H10sing1.08Å1.08Å
C16H11sing1.08Å1.08Å
C9H12sing1.09Å1.10Å
C9H13sing1.09Å1.10Å
C8H14sing1.09Å1.10Å
C8H15sing1.09Å1.10Å
C10H16sing1.09Å1.10Å
C10H17sing1.09Å1.10Å
C11H18sing1.09Å1.10Å
C11H19sing1.09Å1.10Å
O1H20sing0.97Å0.95Å
C6H21sing1.09Å1.10Å
C6H22sing1.09Å1.10Å
C2H23sing1.08Å1.08Å
C4H24sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C21C14C13110.7°109.4°
C21C14C15112.1°109.4°
C21C14H3107.5°109.5°
C14C21H4109.5°109.4°
C14C21H5109.5°109.5°
C14C21H6109.4°109.4°
C13C14C15111.3°109.5°
C14C13C12113.8°109.5°
C14C13H1108.4°109.5°
C14C13H2108.4°109.4°
C13C14H3107.2°109.5°
C14C15C16121.9°120.0°
C14C15C20118.3°120.0°
C15C14H3107.7°109.5°
C13C12O2119.8°119.9°
C13C12N2122.8°120.0°
C12C13H1108.4°109.5°
C12C13H2108.4°109.5°
C15C16C17119.6°120.0°
C16C15C20119.8°120.0°
C15C16H11120.2°120.1°
C16C17C18121.1°120.0°
C16C17H10119.4°120.1°
C17C16H11120.2°119.9°
C15C20C19119.7°119.9°
C15C20H7120.1°120.0°
C17C18C19119.8°119.9°
C17C18H9120.1°120.0°
C18C17H10119.4°119.9°
C20C19C18119.9°120.1°
C19C20H7120.1°120.1°
C20C19H8120.0°120.0°
O2C12N2117.4°120.0°
C12N2C9124.3°120.7°
C12N2C10122.2°120.6°
C18C19H8120.1°120.0°
C19C18H9120.1°120.1°
N2C9C8112.0°108.8°
C9N2C10113.5°118.7°
N2C9H12108.8°109.6°
N2C9H13108.8°109.6°
C9C8C7113.6°109.3°
C8C9H12108.8°109.6°
C8C9H13108.8°109.6°
C9C8H14108.5°109.4°
C9C8H15108.5°109.5°
N2C10C11111.4°108.8°
N2C10H16109.0°109.6°
N2C10H17109.0°109.6°
C8C7C11109.7°109.7°
C8C7C6109.0°109.5°
C8C7O1112.7°109.5°
C7C8H14108.4°109.5°
C7C8H15108.4°109.5°
OC3C121.1°120.6°
OC3N1121.4°120.6°
C4SC96.7°91.4°
SC4C5108.7°110.6°
SC4H24125.6°124.7°
SCC3130.2°131.3°
SCC1110.4°109.6°
C10C11C7107.4°109.3°
C11C10H16109.0°109.6°
C11C10H17109.0°109.5°
C10C11H18110.0°109.5°
C10C11H19110.0°109.6°
CC3N1117.5°118.7°
C3CC1119.4°119.1°
C3N1C6119.1°119.9°
C3N1C2120.6°120.1°
C11C7C6106.1°109.6°
C11C7O1110.3°109.2°
C7C11H18110.0°109.6°
C7C11H19110.0°109.4°
C6C7O1108.8°109.4°
C7C6N1115.5°109.5°
C7C6H21107.9°109.5°
C7C6H22107.9°109.5°
C7O1H20109.5°114.0°
C4C5C1111.6°115.8°
C4C5BR126.8°122.1°
C5C4H24125.6°124.7°
CC1C5112.6°112.6°
CC1N120.9°118.2°
C6N1C2118.7°120.0°
N1C6H21108.0°109.4°
N1C6H22107.9°109.5°
N1C2N123.8°122.2°
N1C2H23118.1°118.9°
C1C5BR121.6°122.1°
C5C1N126.5°129.2°
C1NC2117.8°121.7°
NC2H23118.1°118.8°
H1C13H2109.5°109.4°
H4C21H5109.5°109.5°
H4C21H6109.5°109.4°
H5C21H6109.4°109.5°
H12C9H13109.5°109.7°
H14C8H15109.5°109.6°
H16C10H17109.5°109.7°
H18C11H19109.4°109.5°
H21C6H22109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C21C14C13C15125.4°119.9°
C21C14C13H3117.0°120.0°
C21C14C15H3118.1°120.0°
C21C14C13C12179.8°65.1°
C21C14C15C1639.9°59.7°
C21C14C15C20143.2°120.0°
C21C14C13H159.2°55.0°
C21C14C13H259.6°175.0°
C14C21H4H5120.0°120.0°
C14C21H4H6120.0°119.9°
C14C21H5H6120.0°120.0°
C13C14C15H3117.3°120.0°
C14C13C12H1120.6°120.1°
C14C13C12H2120.6°119.9°
C13C14C15C1684.7°60.3°
C13C14C15C2092.2°120.0°
C14C13C12O273.3°0.1°
C14C13C12N2109.0°180.0°
C14C13H1H2118.0°119.9°
C13C14C21H4180.0°60.1°
C13C14C21H560.0°60.0°
C13C14C21H660.0°180.0°
C15C14C13C1254.4°175.0°
C14C15C16C20176.8°179.7°
C14C15C16C17179.8°179.7°
C14C15C20C19177.4°180.0°
C15C14C13H166.2°64.9°
C15C14C13H2175.0°55.0°
C15C14C21H455.0°180.0°
C15C14C21H5175.0°60.0°
C15C14C21H665.0°60.1°
C14C15C20H72.6°0.0°
C14C15C16H110.2°0.0°
C13C12O2N2177.8°179.9°
C13C12N2C913.3°0.2°
C13C12N2C10169.9°180.0°
C12C13H1H2118.0°120.0°
C12C13C14H363.2°55.0°
C15C16C17H11180.0°179.7°
C15C16C17C182.2°0.6°
C16C15C20C190.5°0.3°
C16C15C14H3158.0°179.7°
C16C15C20H7179.5°179.7°
C15C16C17H10177.8°179.7°
C17C16C15C203.0°0.6°
C16C17C18H10180.0°179.7°
C16C17C18C191.0°0.4°
C16C17C18H9179.0°179.8°
C15C20C19H7180.0°180.0°
C15C20C19C182.7°0.0°
C20C15C14H325.1°0.0°
C15C20C19H8177.3°180.0°
C20C15C16H11177.0°179.7°
C17C18C19C203.5°0.1°
C17C18C19H9180.0°179.9°
C17C18C19H8176.5°180.0°
C18C17C16H11177.8°179.7°
C20C19C18H8180.0°180.0°
C20C19C18H9176.5°180.0°
O2C12N2C9164.5°179.7°
O2C12N2C1012.3°0.0°
O2C12C13H1166.1°120.0°
O2C12C13H247.3°120.0°
C12N2C9C10177.0°179.7°
C12N2C9C8133.7°126.4°
C12N2C10C11125.5°126.3°
N2C12C13H111.6°59.9°
N2C12C13H2130.4°60.0°
C12N2C9H1213.3°6.6°
C12N2C9H13105.9°113.8°
C12N2C10H16114.2°113.8°
C12N2C10H175.2°6.6°
C18C19C20H7177.3°180.0°
C19C18C17H10179.0°179.9°
N2C9C8H12120.4°119.8°
N2C9C8H13120.4°119.8°
N2C9C8C747.7°54.6°
C9N2C10C1157.4°53.9°
N2C9H12H13118.8°120.3°
N2C9C8H1472.9°65.3°
N2C9C8H15168.3°174.6°
C9N2C10H1662.9°65.9°
C9N2C10H17177.7°173.6°
C8C9N2C1049.2°53.9°
C9C8C7H14120.6°119.9°
C9C8C7H15120.6°120.0°
C9C8C7C1154.0°61.1°
C9C8C7C6169.8°178.6°
C9C8C7O169.3°58.7°
C8C9H12H13118.8°120.3°
C9C8H14H15118.2°120.1°
N2C10C11H16120.3°119.8°
N2C10C11H17120.3°119.7°
N2C10C11C761.7°54.6°
C10N2C9H12169.6°173.7°
C10N2C9H1371.1°65.9°
N2C10H16H17119.1°120.4°
N2C10C11H18178.6°174.6°
N2C10C11H1958.0°65.3°
C8C7C11C1058.9°61.1°
C8C7C11C6117.6°120.2°
C8C7C11O1124.7°119.9°
C8C7C6O1123.3°120.0°
C8C7C6N168.4°175.0°
C7C8C9H12168.1°174.4°
C7C8C9H1372.6°65.2°
C7C8H14H15118.1°120.1°
C8C7C11H18178.6°178.9°
C8C7C11H1960.8°58.9°
C8C7O1H20180.0°180.0°
C8C7C6H21170.6°55.0°
C8C7C6H2252.4°65.0°
OC3CS0.1°0.0°
OC3CN1179.6°179.9°
OC3CC1179.3°180.0°
OC3N1C614.0°0.1°
OC3N1C2179.1°180.0°
C4SCC3179.9°180.0°
SC4C5H24180.0°180.0°
C4SCC10.7°0.0°
SC4C5C11.9°0.0°
SC4C5BR179.3°180.0°
SCC3C1179.4°180.0°
SCC3N1179.7°180.0°
CSC4C51.5°0.0°
SCC1C50.4°0.0°
SCC1N179.2°180.0°
CSC4H24178.5°180.0°
C10C11C7H18119.7°120.0°
C10C11C7H19119.7°120.0°
C10C11C7C6176.6°178.7°
C10C11C7O165.8°58.8°
C11C10H16H17119.1°120.3°
C10C11H18H19121.0°120.2°
CC3N1C6165.6°180.0°
CC3N1C20.5°0.1°
C3CC1C5179.2°180.0°
C3CC1N0.3°0.1°
C3N1C6C789.5°90.0°
N1C3CC10.3°0.1°
C3N1C6C2165.4°179.9°
C3N1C2N0.2°0.1°
C3N1C6H21149.6°150.1°
C3N1C6H2231.3°30.1°
C3N1C2H23179.8°179.9°
C11C7C6O1118.6°119.7°
C11C7C6N1173.5°54.7°
C11C7C8H1466.6°58.8°
C11C7C8H15174.6°179.0°
C7C11C10H1658.6°65.3°
C7C11C10H17178.1°174.3°
C7C11H18H19120.9°120.0°
C11C7O1H2057.0°59.9°
C11C7C6H2152.6°65.3°
C11C7C6H2265.7°174.7°
C7C6N1H21120.9°120.0°
C7C6N1H22120.9°120.1°
C7C6N1C275.9°90.0°
C6C7C8H1449.2°61.5°
C6C7C8H1569.6°58.7°
C6C7C11H1863.8°58.7°
C6C7C11H1956.8°61.3°
C6C7O1H2059.0°60.1°
C7C6H21H22117.2°120.0°
O1C7C6N154.8°65.0°
O1C7C8H14170.1°178.5°
O1C7C8H1551.4°61.3°
O1C7C11H1853.9°61.2°
O1C7C11H19174.5°178.8°
O1C7C6H2166.1°175.0°
O1C7C6H22175.7°55.0°
C4C5C1C1.5°0.0°
C4C5C1BR178.9°180.0°
C4C5C1N179.7°180.0°
CC1C5N178.8°179.9°
CC1C5BR179.7°180.0°
CC1NC20.6°0.0°
C6N1C2N165.3°180.0°
N1C6H21H22117.3°120.0°
C6N1C2H2314.7°0.0°
N1C2NC10.4°0.0°
N1C2NH23180.0°180.0°
C2N1C6H2145.0°30.0°
C2N1C6H22163.3°150.0°
C5C1NC2179.3°180.0°
C1C5C4H24178.1°180.0°
BRC5C1N0.9°0.1°
BRC5C4H240.7°0.1°
C1NC2H23179.6°180.0°
H1C13C14H3176.2°175.1°
H2C13C14H357.4°65.0°
H3C14C21H463.2°60.0°
H3C14C21H556.8°180.0°
H3C14C21H6176.8°59.9°
H4C21H5H6120.0°120.0°
H7C20C19H82.7°0.0°
H8C19C18H93.5°0.1°
H9C18C17H101.0°0.1°
H10C17C16H112.2°0.0°
H12C9C8H1447.5°54.5°
H12C9C8H1571.3°65.6°
H13C9C8H14166.8°174.9°
H13C9C8H1548.0°54.8°
H16C10C11H1861.1°54.8°
H16C10C11H19178.3°174.9°
H17C10C11H1858.4°65.7°
H17C10C11H1962.3°54.4°

249697

PDB entries from 2026-02-25

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