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R0T

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1C1doub1.30Å1.31ÅAromatic
N1Nsing1.40Å1.36ÅAromatic
CNsing1.47Å1.46Å
C1C3sing1.41Å1.42ÅAromatic
NC2sing1.36Å1.37ÅAromatic
C3C2doub1.41Å1.39ÅAromatic
C3C4sing1.41Å1.43ÅAromatic
C2N8sing1.33Å1.34ÅAromatic
N8C24doub1.32Å1.35ÅAromatic
C4N2sing1.38Å1.36Å
C4N6doub1.33Å1.32ÅAromatic
N2C5sing1.40Å1.38Å
C23C22sing1.51Å1.51Å
C24N6sing1.33Å1.35ÅAromatic
C24C25sing1.48Å1.47Å
C5C22doub1.39Å1.41ÅAromatic
C5C6sing1.39Å1.40ÅAromatic
C22C21sing1.38Å1.40ÅAromatic
C6C7doub1.39Å1.40ÅAromatic
C25C26doub1.40Å1.39ÅAromatic
C25C29sing1.39Å1.39ÅAromatic
C26C27sing1.39Å1.38ÅAromatic
C21C20doub1.38Å1.38ÅAromatic
C7C20sing1.40Å1.39ÅAromatic
C7C8sing1.48Å1.49Å
C29N7doub1.32Å1.34ÅAromatic
C27C28doub1.38Å1.37ÅAromatic
OC8doub1.21Å1.22Å
C8N3sing1.35Å1.35Å
FC18sing1.40Å1.32Å
C28N7sing1.32Å1.34ÅAromatic
N3C9sing1.40Å1.42Å
C19C9doub1.39Å1.39ÅAromatic
C19C17sing1.38Å1.40ÅAromatic
C18F2sing1.40Å1.31Å
C18C17sing1.51Å1.49Å
C18F1sing1.40Å1.33Å
C9C10sing1.39Å1.39ÅAromatic
C17C16doub1.38Å1.40ÅAromatic
C10C11doub1.39Å1.39ÅAromatic
C16C11sing1.39Å1.39ÅAromatic
C11N4sing1.40Å1.43Å
N4C15sing1.37Å1.38ÅAromatic
N4C12sing1.36Å1.36ÅAromatic
C15C13doub1.35Å1.36ÅAromatic
C12N5doub1.31Å1.31ÅAromatic
C13N5sing1.34Å1.40ÅAromatic
C13C14sing1.51Å1.50Å
N3H6sing0.97Å1.00Å
C6H5sing1.08Å1.08Å
C10H7sing1.08Å1.08Å
C15H12sing1.08Å1.08Å
C20H15sing1.08Å1.08Å
C21H16sing1.08Å1.08Å
C26H20sing1.08Å1.08Å
C28H22sing1.08Å1.08Å
CH1sing1.09Å1.10Å
CH2sing1.09Å1.10Å
CHsing1.09Å1.10Å
C1H3sing1.08Å1.08Å
C12H8sing1.08Å1.08Å
C14H11sing1.09Å1.10Å
C14H10sing1.09Å1.10Å
C14H9sing1.09Å1.10Å
C16H13sing1.08Å1.08Å
C19H14sing1.08Å1.08Å
C23H19sing1.09Å1.10Å
C23H17sing1.09Å1.10Å
C23H18sing1.09Å1.10Å
C27H21sing1.08Å1.08Å
C29H23sing1.08Å1.08Å
N2H4sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1N1N106.6°109.8°
N1C1C3111.1°108.5°
N1C1H3124.5°125.8°
N1NC121.4°125.9°
N1NC2110.8°108.2°
CNC2127.8°125.9°
NCH1109.5°109.5°
NCH2109.4°109.5°
NCH109.4°109.4°
C1C3C2104.6°107.1°
C1C3C4140.8°134.5°
C3C1H3124.4°125.7°
NC2C3106.9°106.5°
NC2N8127.5°134.5°
C2C3C4114.4°118.4°
C3C2N8125.6°118.9°
C3C4N2122.2°120.8°
C3C4N6121.4°118.5°
C2N8C24114.2°120.7°
N8C24N6126.2°122.4°
N8C24C25118.2°118.8°
N2C4N6115.9°120.8°
C4N2C5132.7°120.0°
C4N2H4113.7°120.0°
C4N6C24118.1°121.2°
N2C5C22116.5°120.0°
N2C5C6123.3°120.0°
C5N2H4113.6°120.0°
C23C22C5121.5°119.9°
C23C22C21120.6°119.9°
C22C23H19109.5°109.4°
C22C23H17109.5°109.5°
C22C23H18109.4°109.5°
N6C24C25115.6°118.8°
C24C25C26121.9°120.6°
C24C25C29121.6°120.5°
C22C5C6119.4°120.0°
C5C22C21118.0°120.2°
C5C6C7121.8°119.8°
C5C6H5119.1°120.1°
C22C21C20121.8°120.2°
C22C21H16119.1°119.9°
C6C7C20118.3°119.8°
C6C7C8116.6°120.1°
C7C6H5119.1°120.1°
C26C25C29116.5°118.9°
C25C26C27120.6°118.3°
C25C26H20119.7°120.9°
C25C29N7124.1°120.5°
C25C29H23117.9°119.7°
C26C27C28118.2°119.3°
C27C26H20119.7°120.8°
C26C27H21120.9°120.3°
C21C20C7120.5°120.0°
C21C20H15119.8°120.0°
C20C21H16119.1°119.9°
C20C7C8124.9°120.1°
C7C20H15119.7°120.0°
C7C8O120.3°120.0°
C7C8N3117.0°119.9°
C29N7C28117.1°121.9°
N7C29H23117.9°119.7°
C27C28N7123.5°121.0°
C27C28H22118.3°119.5°
C28C27H21120.9°120.4°
OC8N3122.6°120.0°
C8N3C9126.7°119.9°
C8N3H6116.7°120.0°
FC18F2106.6°109.5°
FC18C17111.9°109.5°
FC18F1108.1°109.4°
N7C28H22118.2°119.5°
N3C9C19123.2°120.1°
N3C9C10116.8°120.0°
C9N3H6116.7°120.0°
C9C19C17119.7°120.1°
C19C9C10120.0°119.9°
C9C19H14120.2°119.9°
C19C17C18119.4°119.9°
C19C17C16120.0°120.1°
C17C19H14120.2°120.0°
F2C18C17112.1°109.5°
F2C18F1104.0°109.5°
C17C18F1113.6°109.4°
C18C17C16120.6°120.0°
C9C10C11120.1°119.9°
C9C10H7119.9°120.1°
C17C16C11119.8°120.1°
C17C16H13120.1°120.0°
C10C11C16120.4°120.0°
C10C11N4119.8°120.0°
C11C10H7119.9°120.0°
C16C11N4119.6°120.0°
C11C16H13120.1°120.0°
C11N4C15126.0°126.5°
C11N4C12127.3°126.5°
C15N4C12106.6°107.1°
N4C15C13106.1°106.8°
N4C15H12126.9°126.6°
N4C12N5112.4°108.6°
N4C12H8123.8°125.8°
C15C13N5110.1°108.2°
C15C13C14128.8°125.9°
C13C15H12126.9°126.6°
C12N5C13104.7°109.3°
N5C12H8123.8°125.7°
N5C13C14121.1°125.9°
C13C14H11109.5°109.5°
C13C14H10109.5°109.5°
C13C14H9109.5°109.5°
H1CH2109.5°109.5°
H1CH109.4°109.5°
H2CH109.5°109.5°
H11C14H10109.5°109.5°
H11C14H9109.5°109.4°
H10C14H9109.5°109.5°
H19C23H17109.4°109.5°
H19C23H18109.5°109.5°
H17C23H18109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C1N1NC178.8°179.9°
N1C1C3H3180.0°180.0°
C1N1NC20.8°0.0°
N1C1C3C20.7°0.0°
N1C1C3C4173.9°180.0°
N1NCC2177.7°179.9°
NN1C1C30.9°0.0°
N1NC2C30.3°0.0°
N1NC2N8177.1°180.0°
N1NCH10.0°89.9°
N1NCH2120.0°150.0°
N1NCH120.0°30.1°
NN1C1H3179.0°180.0°
CNC2C3178.2°180.0°
CNC2N80.7°0.1°
NCH1H2120.0°120.0°
NCH1H120.0°120.0°
NCH2H120.0°119.9°
C1C3C2N0.2°0.0°
C1C3C2C4176.3°180.0°
C1C3C2N8177.8°180.0°
C1C3C4N212.9°0.0°
C1C3C4N6176.1°180.0°
NC2C3N8177.5°179.9°
NC2C3C4176.1°180.0°
NC2N8C24176.8°180.0°
C2NCH1177.7°90.0°
C2NCH257.7°30.1°
C2NCH62.3°150.0°
C3C2N8C240.2°0.0°
C2C3C4N2172.8°180.0°
C2C3C4N61.7°0.0°
C2C3C1H3179.2°180.0°
C4C3C2N81.5°0.1°
C3C4N2N6171.5°180.0°
C3C4N2C5169.4°174.6°
C3C4N6C240.8°0.0°
C4C3C1H36.1°0.0°
C3C4N2H410.5°5.4°
C2N8C24N61.0°0.0°
C2N8C24C25178.9°179.9°
N8C24N6C40.7°0.1°
N8C24N6C25179.9°179.9°
N8C24C25C262.7°177.1°
N8C24C25C29179.7°2.8°
C4N2C5H4180.0°180.0°
N2C4N6C24172.3°179.9°
C4N2C5C2299.1°142.5°
C4N2C5C670.8°37.2°
N6C4N2C519.0°5.4°
C4N6C24C25179.2°179.9°
N6C4N2H4161.0°174.7°
N2C5C22C234.6°0.3°
N2C5C22C6170.3°179.7°
N2C5C22C21173.8°179.7°
N2C5C6C7176.0°179.7°
N2C5C6H54.0°0.3°
C23C22C5C21178.4°180.0°
C23C22C5C6174.9°180.0°
C23C22C21C20179.4°180.0°
C23C22C21H160.6°0.0°
C22C23H19H17120.0°120.0°
C22C23H19H18120.0°120.0°
C22C23H17H18120.0°120.0°
N6C24C25C26177.2°3.0°
N6C24C25C290.4°177.1°
C24C25C26C29177.8°180.0°
C24C25C26C27178.1°180.0°
C24C25C29N7178.4°179.9°
C24C25C26H201.9°0.4°
C24C25C29H231.6°0.0°
C22C5C6C76.4°0.0°
C5C22C21C201.0°0.0°
C22C5C6H5173.6°180.0°
C5C22C21H16179.0°180.0°
C5C22C23H1989.2°90.0°
C5C22C23H17150.8°150.0°
C5C22C23H1830.8°30.0°
C22C5N2H481.0°37.5°
C6C5C22C213.5°0.0°
C5C6C7H5180.0°180.0°
C5C6C7C204.6°0.0°
C5C6C7C8169.6°180.0°
C6C5N2H4109.2°142.8°
C22C21C20H16180.0°179.9°
C22C21C20C72.8°0.1°
C22C21C20H15177.2°179.9°
C21C22C23H1989.2°90.0°
C21C22C23H1730.8°30.0°
C21C22C23H18150.8°150.0°
C6C7C20C210.0°0.0°
C6C7C20C8173.6°180.0°
C6C7C8O5.0°4.6°
C6C7C8N3171.6°175.5°
C6C7C20H15179.9°179.9°
C25C26C27H20180.0°179.6°
C26C25C29N70.6°0.0°
C25C26C27C280.1°0.3°
C25C26C27H21179.9°179.7°
C26C25C29H23179.4°180.0°
C29C25C26C270.4°0.0°
C25C29N7H23180.0°180.0°
C25C29N7C280.3°0.3°
C29C25C26H20179.6°179.7°
C26C27C28H21180.0°180.0°
C26C27C28N70.4°0.6°
C26C27C28H22179.6°180.0°
C21C20C7H15180.0°179.9°
C21C20C7C8173.7°179.9°
C20C7C8O178.7°175.4°
C20C7C8N32.1°4.5°
C20C7C6H5175.4°180.0°
C7C20C21H16177.2°180.0°
C7C8ON3176.4°179.9°
C7C8N3C9169.7°171.3°
C7C8N3H610.2°8.7°
C8C7C6H510.4°0.0°
C8C7C20H156.3°0.1°
C29N7C28C270.2°0.6°
C29N7C28H22179.8°180.0°
C27C28N7H22180.0°179.4°
C28C27C26H20179.9°179.9°
OC8N3C96.8°8.6°
OC8N3H6173.3°171.3°
C8N3C9H6180.0°180.0°
C8N3C9C1918.8°30.1°
C8N3C9C10160.2°149.9°
FC18C17C1946.4°35.4°
FC18F2C17122.8°120.0°
FC18F2F1114.0°120.0°
FC18C17F1122.8°120.0°
FC18C17C16136.3°145.1°
N7C28C27H21179.6°179.4°
C28N7C29H23179.7°179.7°
N3C9C19C10179.0°180.0°
N3C9C19C17180.0°179.5°
N3C9C10C11179.1°179.9°
N3C9C10H71.0°0.3°
N3C9C19H140.0°0.0°
C9C19C17H14180.0°179.5°
C9C19C17C18177.0°179.8°
C9C19C17C160.3°0.7°
C19C9C10C111.9°0.0°
C19C9N3H6161.2°149.9°
C19C9C10H7178.1°179.7°
C19C17C18F273.3°84.6°
C19C17C18C16177.3°179.5°
C19C17C18F1169.2°155.3°
C17C19C9C101.1°0.5°
C19C17C16C110.9°0.5°
C19C17C16H13179.1°179.5°
F2C18C17F1117.6°120.0°
F2C18C17C16104.0°94.8°
C18C17C16C11176.4°180.0°
C18C17C16H133.6°0.0°
C18C17C19H143.0°0.3°
F1C18C17C1613.5°25.2°
C9C10C11H7180.0°179.7°
C9C10C11C161.3°0.3°
C9C10C11N4174.1°179.7°
C10C9N3H619.8°30.1°
C10C9C19H14178.9°180.0°
C17C16C11C100.1°0.0°
C17C16C11H13180.0°180.0°
C17C16C11N4175.5°180.0°
C16C17C19H14179.7°179.7°
C10C11C16N4175.5°180.0°
C10C11N4C15118.6°0.1°
C10C11N4C1256.4°179.9°
C10C11C16H13180.0°180.0°
C16C11N4C1556.9°179.9°
C16C11N4C12128.1°0.1°
C16C11C10H7178.6°180.0°
C11N4C15C12175.9°179.9°
C11N4C15C13174.7°179.9°
C11N4C12N5175.0°179.9°
N4C11C10H75.9°0.0°
C11N4C15H125.3°0.2°
C11N4C12H85.0°0.1°
N4C11C16H134.5°0.0°
N4C15C13H12180.0°179.9°
C15N4C12N50.8°0.1°
N4C15C13N51.2°0.1°
N4C15C13C14177.3°179.7°
C15N4C12H8179.3°180.0°
C12N4C15C131.1°0.1°
N4C12N5H8180.0°179.9°
N4C12N5C130.1°0.0°
C12N4C15H12178.8°180.0°
C15C13N5C120.7°0.0°
C15C13N5C14178.6°179.7°
C15C13C14H11178.3°90.3°
C15C13C14H1061.7°29.7°
C15C13C14H958.2°149.7°
C12N5C13C14177.9°179.7°
N5C13C15H12178.8°180.0°
C13N5C12H8180.0°180.0°
N5C13C14H110.0°90.0°
N5C13C14H10120.0°150.0°
N5C13C14H9120.0°30.0°
C14C13C15H122.7°0.2°
C13C14H11H10120.0°120.0°
C13C14H11H9120.0°120.0°
C13C14H10H9120.0°120.1°
H15C20C21H162.8°0.1°
H20C26C27H210.1°0.0°
H22C28C27H210.4°0.0°
H1CH2H120.0°120.0°
H11C14H10H9120.0°119.9°
H19C23H17H18120.0°120.1°

222415

PDB entries from 2024-07-10

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