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1TT

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
F16C13sing1.40Å1.33Å
F15C13sing1.40Å1.33Å
F14C13sing1.40Å1.33Å
C13C8sing1.53Å1.52Å
C8C9sing1.52Å1.54Å
C8N7sing1.45Å1.47Å
C30C21sing1.53Å1.52Å
C10C9sing1.52Å1.53Å
C10N5sing1.45Å1.47Å
C22N7sing1.47Å1.52Å
C22C23sing1.51Å1.50Å
N7C6sing1.44Å1.44Å
N5C6sing1.45Å1.42Å
N5C1sing1.37Å1.46Å
O12C1doub1.21Å1.24Å
C6N4sing1.46Å1.35Å
C1C2sing1.52Å1.46Å
N4C3doub1.31Å1.40Å
C2C3sing1.52Å1.42Å
C3N11sing1.37Å1.32Å
C21N11sing1.47Å1.53Å
C21C20sing1.53Å1.52Å
N11C17sing1.47Å1.47Å
C17C18sing1.53Å1.51Å
C23C24doub1.39Å1.41ÅAromatic
C23C28sing1.38Å1.43ÅAromatic
C24C25sing1.39Å1.42ÅAromatic
O19C20sing1.43Å1.44Å
O19C18sing1.43Å1.43Å
C28N27doub1.32Å1.37ÅAromatic
C25CL1sing1.74Å1.73Å
C25C26doub1.38Å1.42ÅAromatic
N27C26sing1.32Å1.37ÅAromatic
C2H1sing1.09Å1.10Å
C2H2sing1.09Å1.10Å
C8H3sing1.09Å1.10Å
C9H4sing1.09Å1.10Å
C9H5sing1.09Å1.10Å
C10H6sing1.09Å1.10Å
C10H7sing1.09Å1.10Å
C20H8sing1.09Å1.10Å
C20H9sing1.09Å1.10Å
C21H10sing1.09Å1.10Å
C22H11sing1.09Å1.10Å
C22H12sing1.09Å1.10Å
C24H13sing1.08Å1.08Å
C30H14sing1.09Å1.10Å
C30H15sing1.09Å1.10Å
C30H16sing1.09Å1.10Å
C6H17sing1.09Å1.10Å
C17H19sing1.09Å1.10Å
C17H20sing1.09Å1.10Å
C18H21sing1.09Å1.10Å
C18H22sing1.09Å1.10Å
C26H23sing1.08Å1.08Å
C28H24sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
F16C13F15106.8°109.5°
F16C13F14106.6°109.5°
F16C13C8112.9°109.5°
F15C13F14106.7°109.5°
F15C13C8110.9°109.5°
F14C13C8112.6°109.4°
C13C8C9114.1°109.0°
C13C8N7112.1°109.0°
C13C8H3107.0°108.8°
C9C8N7108.9°112.0°
C8C9C10111.1°111.3°
C9C8H3106.8°109.0°
C8C9H4109.1°109.1°
C8C9H5109.1°109.1°
C8N7C22122.2°111.0°
C8N7C6116.4°116.8°
N7C8H3107.5°109.0°
C30C21N11111.6°109.7°
C30C21C20113.2°109.7°
C30C21H10106.7°109.7°
C21C30H14109.5°109.5°
C21C30H15109.4°109.5°
C21C30H16109.5°109.4°
C9C10N5110.7°112.6°
C10C9H4109.1°109.1°
C10C9H5109.1°109.1°
C9C10H6109.2°108.9°
C9C10H7109.1°108.8°
C10N5C6123.1°124.9°
C10N5C1117.9°118.8°
N5C10H6109.1°108.9°
N5C10H7109.2°108.8°
N7C22C23111.7°109.4°
C22N7C6117.7°111.0°
N7C22H11108.9°109.5°
N7C22H12108.9°109.5°
C22C23C24121.9°120.5°
C22C23C28120.5°120.4°
C23C22H11108.9°109.4°
C23C22H12108.9°109.5°
N7C6N5120.3°117.1°
N7C6N4116.3°113.3°
N7C6H1791.2°104.8°
C6N5C1119.0°116.2°
N5C6N4123.3°109.8°
N5C6H1791.2°105.4°
N5C1O12115.6°122.0°
N5C1C2116.0°115.9°
O12C1C2128.4°122.1°
C6N4C3120.5°117.2°
N4C6H1791.2°105.2°
C1C2C3121.4°107.8°
C1C2H1106.4°109.8°
C1C2H2106.4°109.8°
N4C3C2119.5°117.4°
N4C3N11114.7°121.3°
C2C3N11125.1°121.3°
C3C2H1106.4°109.8°
C3C2H2106.4°109.8°
C3N11C21124.8°121.0°
C3N11C17118.9°121.0°
N11C21C20111.6°108.4°
C21N11C17115.8°118.0°
N11C21H10106.6°109.7°
C21C20O19111.7°109.3°
C21C20H8108.9°109.5°
C21C20H9108.9°109.5°
C20C21H10106.8°109.7°
N11C17C18110.5°108.4°
N11C17H19109.2°109.7°
N11C17H20109.2°109.6°
C17C18O19112.0°109.3°
C18C17H19109.2°109.7°
C18C17H20109.2°109.7°
C17C18H21108.8°109.5°
C17C18H22108.8°109.5°
C24C23C28117.6°119.1°
C23C24C25118.6°118.4°
C23C24H13120.7°120.8°
C23C28N27124.3°120.8°
C23C28H24117.9°119.6°
C24C25CL1120.2°120.4°
C24C25C26120.3°119.1°
C25C24H13120.7°120.8°
C20O19C18110.8°114.1°
O19C20H8108.9°109.4°
O19C20H9108.9°109.5°
O19C18H21108.8°109.5°
O19C18H22108.9°109.6°
C28N27C26117.9°121.7°
N27C28H24117.8°119.6°
CL1C25C26119.5°120.5°
C25C26N27121.3°120.8°
C25C26H23119.3°119.6°
N27C26H23119.3°119.6°
H1C2H2109.5°109.8°
H4C9H5109.4°109.1°
H6C10H7109.5°108.8°
H8C20H9109.5°109.6°
H11C22H12109.5°109.5°
H14C30H15109.5°109.5°
H14C30H16109.5°109.5°
H15C30H16109.5°109.5°
H19C17H20109.4°109.7°
H21C18H22109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
F16C13F15F14113.7°120.0°
F16C13F15C8123.4°120.0°
F16C13F14C8124.3°120.0°
F16C13C8C939.0°52.3°
F16C13C8N7163.5°174.8°
F16C13C8H378.8°66.5°
F15C13F14C8121.9°120.0°
F15C13C8C9158.8°172.3°
F15C13C8N776.7°65.2°
F15C13C8H340.9°53.5°
F14C13C8C981.8°67.7°
F14C13C8N742.7°54.8°
F14C13C8H3160.4°173.5°
C13C8C9N7126.2°120.6°
C13C8C9H3118.0°118.7°
C13C8N7H3117.3°118.6°
C13C8C9C1063.1°62.4°
C13C8N7C2275.4°56.1°
C13C8N7C682.3°72.5°
C13C8C9H457.2°58.1°
C13C8C9H5176.7°177.2°
C9C8N7H3115.3°120.7°
C8C9C10H4120.3°120.4°
C8C9C10H5120.3°120.5°
C8C9C10N546.9°39.5°
C9C8N7C22157.3°176.8°
C9C8N7C645.0°48.1°
C8C9H4H5119.3°119.1°
C8C9C10H673.2°81.3°
C8C9C10H7167.1°160.2°
N7C8C9C1063.1°58.3°
C8N7C22C6157.4°131.7°
C8N7C22C23124.8°67.9°
C8N7C6N513.0°19.6°
C8N7C6N4163.0°109.9°
N7C8C9H4176.6°178.7°
N7C8C9H557.1°62.2°
C8N7C22H114.4°52.0°
C8N7C22H12114.9°172.0°
C8N7C6H17105.0°135.9°
C30C21N11C386.2°9.7°
C30C21N11C20127.7°119.7°
C30C21N11H10116.1°120.5°
C30C21C20H10117.1°120.5°
C30C21N11C1785.7°170.3°
C30C21C20O1978.4°172.1°
C30C21C20H842.0°52.2°
C30C21C20H9161.3°68.0°
C21C30H14H15120.0°120.0°
C21C30H14H16120.0°120.0°
C21C30H15H16120.0°120.0°
C9C10N5H6120.2°120.9°
C9C10N5H7120.2°120.7°
C9C10N5C614.4°12.5°
C9C10N5C1164.7°169.3°
C10C9C8H3178.9°179.0°
C10C9H4H5119.3°119.1°
C9C10H6H7119.5°118.5°
C10N5C6N73.5°1.4°
C10N5C6C1179.0°178.2°
C10N5C1O120.6°5.2°
C10N5C6N4179.2°129.7°
C10N5C1C2178.8°175.0°
N5C10C9H4167.2°159.9°
N5C10C9H573.3°81.0°
N5C10H6H7119.5°118.4°
C10N5C6H1788.6°117.5°
N7C22C23H11120.3°120.0°
N7C22C23H12120.3°120.0°
C22N7C6N5171.7°148.2°
C22N7C6N44.3°18.7°
N7C22C23C24137.0°96.2°
N7C22C23C2841.1°83.8°
C22N7C8H341.9°62.5°
N7C22H11H12119.0°120.1°
C22N7C6H1796.3°95.4°
C23C22N7C677.8°160.4°
C22C23C24C28178.2°179.9°
C22C23C24C25179.1°180.0°
C22C23C28N27179.3°179.4°
C23C22H11H12119.0°120.0°
C22C23C24H130.9°0.3°
C22C23C28H240.7°0.0°
N7C6N5N4175.7°131.1°
N7C6N5H1792.0°116.1°
N7C6N5C1177.5°179.7°
N7C6N4H1791.9°113.9°
N7C6N4C3179.2°179.6°
C6N7C8H3160.4°168.8°
C6N7C22H11161.8°79.7°
C6N7C22H1242.5°40.4°
C6N5C1O12179.7°176.4°
N5C6N4H1792.2°113.0°
C6N5C1C20.3°3.4°
N5C6N4C35.0°47.3°
C6N5C10H6105.8°108.4°
C6N5C10H7134.5°133.3°
N5C1O12C2179.3°179.7°
C1N5C6N41.8°48.5°
N5C1C2C30.8°41.6°
N5C1C2H1120.9°161.2°
N5C1C2H2122.4°78.0°
C1N5C10H675.2°69.8°
C1N5C10H744.5°48.5°
C1N5C6H1790.5°64.3°
O12C1C2C3178.5°138.6°
O12C1C2H159.8°19.0°
O12C1C2H256.9°101.8°
C6N4C3C25.9°0.1°
C6N4C3N11176.5°179.9°
C1C2C3N43.8°44.1°
C1C2C3H1121.6°119.6°
C1C2C3H2121.7°119.6°
C1C2C3N11173.4°135.9°
C1C2H1H2114.6°120.8°
N4C3C2N11169.5°180.0°
N4C3N11C21158.0°5.8°
N4C3N11C1713.7°174.2°
N4C3C2H1117.8°163.7°
N4C3C2H2125.5°75.5°
C3N4C6H1787.2°65.7°
C2C3N11C2112.0°174.3°
C2C3N11C17176.3°5.7°
C3C2H1H2114.6°120.8°
C3N11C21C17171.9°180.0°
C3N11C21C20146.1°129.5°
C3N11C17C18143.5°129.5°
N11C3C2H151.7°16.3°
N11C3C2H265.0°104.5°
C3N11C21H1029.9°110.8°
C3N11C17H1923.4°110.7°
C3N11C17H2096.3°9.7°
N11C21C20H10116.1°119.7°
C21N11C17C1844.1°50.6°
N11C21C20O1948.5°52.3°
N11C21C20H8168.8°67.6°
N11C21C20H971.9°172.3°
N11C21C30H14180.0°68.4°
N11C21C30H1560.0°171.6°
N11C21C30H1660.0°51.6°
C21N11C17H19164.3°69.2°
C21N11C17H2076.1°170.3°
C20C21N11C1742.0°50.5°
C21C20O19H8120.4°119.9°
C21C20O19H9120.3°120.0°
C21C20O19C1860.3°62.5°
C21C20H8H9119.0°120.1°
C20C21C30H1453.2°172.6°
C20C21C30H1566.8°52.6°
C20C21C30H16173.2°67.4°
N11C17C18H19120.2°119.8°
N11C17C18H20120.2°119.7°
N11C17C18O1954.4°52.4°
C17N11C21H10158.2°69.2°
N11C17H19H20119.5°120.5°
N11C17C18H2165.9°172.3°
N11C17C18H22174.8°67.7°
C17C18O19C2063.5°62.5°
C17C18O19H21120.4°119.9°
C17C18O19H22120.4°120.0°
C18C17H19H20119.5°120.6°
C17C18H21H22118.9°120.1°
C23C24C25H13180.0°179.7°
C24C23C28N271.1°0.5°
C23C24C25CL1178.7°179.7°
C23C24C25C260.3°0.3°
C24C23C22H11102.6°23.7°
C24C23C22H1216.7°143.7°
C24C23C28H24178.9°180.0°
C28C23C24C250.9°0.0°
C23C28N27H24180.0°179.4°
C23C28N27C260.6°0.9°
C28C23C22H1179.3°156.2°
C28C23C22H12161.4°36.2°
C28C23C24H13179.1°179.7°
C24C25CL1C26178.4°180.0°
C24C25C26N270.2°0.0°
C24C25C26H23179.8°180.0°
O19C20H8H9119.0°120.1°
O19C20C21H10164.6°67.4°
C20O19C18H2156.8°177.6°
C20O19C18H22176.1°57.5°
C18O19C20H8179.3°57.4°
C18O19C20H960.0°177.5°
O19C18C17H19174.6°67.4°
O19C18C17H2065.8°172.0°
O19C18H21H22118.9°120.1°
C28N27C26C250.0°0.6°
C28N27C26H23180.0°179.4°
CL1C25C26N27178.2°180.0°
CL1C25C24H131.3°0.0°
CL1C25C26H231.8°0.0°
C25C26N27H23180.0°180.0°
C26C25C24H13179.7°180.0°
C26N27C28H24179.3°179.7°
H3C8C9H460.8°60.6°
H3C8C9H558.7°58.5°
H4C9C10H647.0°39.1°
H4C9C10H772.7°79.3°
H5C9C10H6166.5°158.2°
H5C9C10H746.8°39.7°
H8C20C21H1075.1°172.7°
H9C20C21H1044.2°52.5°
H10C21C30H1463.9°52.1°
H10C21C30H15176.0°67.9°
H10C21C30H1656.1°172.0°
H14C30H15H16120.0°120.0°
H19C17C18H2154.2°52.5°
H19C17C18H2265.1°172.6°
H20C17C18H21173.9°68.1°
H20C17C18H2254.6°52.0°

222415

PDB entries from 2024-07-10

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