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JI4

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1C1sing1.47Å1.46Å
C2C1sing1.53Å1.53Å
C1H1sing1.09Å1.10Å
C1H1Asing1.09Å1.10Å
N1C3'sing1.47Å1.46Å
N1HN1sing1.01Å1.00Å
N2C2sing1.47Å1.46Å
C2H2sing1.09Å1.10Å
C2H2Asing1.09Å1.10Å
C3N2sing1.47Å1.46Å
N2HN2sing1.01Å1.00Å
C4C3sing1.53Å1.52Å
C3H3sing1.09Å1.10Å
C3H3Asing1.09Å1.10Å
C11C4sing1.51Å1.51Å
C4H4sing1.09Å1.10Å
C4H4Asing1.09Å1.10Å
C2'N1'sing1.49Å1.44Å
N1'C5'sing1.49Å1.45Å
N1'HN1'sing1.01Å1.00Å
C12C11doub1.38Å1.40ÅAromatic
C16C11sing1.38Å1.40ÅAromatic
C13C12sing1.38Å1.39ÅAromatic
C12H12sing1.08Å1.08Å
F13C13sing1.35Å1.34Å
C14C13doub1.38Å1.40ÅAromatic
C14C15sing1.38Å1.39ÅAromatic
C14H14sing1.08Å1.08Å
C15C16doub1.38Å1.40ÅAromatic
C15H15sing1.08Å1.08Å
C16H16sing1.08Å1.08Å
N11C21doub1.32Å1.35ÅAromatic
N11C61sing1.32Å1.36ÅAromatic
C2'C3'sing1.54Å1.54Å
C2'H2'sing1.09Å1.10Å
C2'H2'Asing1.09Å1.10Å
C71C21sing1.51Å1.53Å
C21C31sing1.38Å1.39ÅAromatic
C3'C4'sing1.54Å1.55Å
C3'H3'sing1.09Å1.10Å
C31C41doub1.39Å1.39ÅAromatic
C31H31sing1.08Å1.08Å
C71C4'sing1.53Å1.53Å
C4'C5'sing1.54Å1.54Å
C4'H4'sing1.09Å1.10Å
C51C41sing1.38Å1.40ÅAromatic
C41C81sing1.51Å1.51Å
C5'H5'sing1.09Å1.10Å
C5'H5'Asing1.09Å1.10Å
C61C51doub1.39Å1.40ÅAromatic
C51H51sing1.08Å1.08Å
N61C61sing1.39Å1.35Å
N61HN61sing0.97Å1.00Å
N61HN6Asing0.97Å1.00Å
C71H71sing1.09Å1.10Å
C71H71Asing1.09Å1.10Å
C81H81sing1.09Å1.10Å
C81H81Asing1.09Å1.10Å
C81H81Bsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N1C1C2111.1°109.5°
N1C1H1108.9°109.4°
N1C1H1A109.0°109.5°
C1N1C3'121.8°111.0°
C1N1HN1105.6°111.0°
C2C1H1108.9°109.4°
C2C1H1A108.9°109.5°
C1C2N2113.7°109.5°
C1C2H2108.1°109.4°
C1C2H2A108.1°109.5°
H1C1H1A110.0°109.4°
C3'N1HN1105.6°111.0°
N1C3'C2'110.0°110.3°
N1C3'C4'116.6°110.3°
N1C3'H3'102.6°110.3°
N2C2H2108.1°109.4°
N2C2H2A108.1°109.5°
C2N2C3118.2°111.0°
C2N2HN2106.6°111.0°
H2C2H2A110.8°109.4°
C3N2HN2106.6°111.0°
N2C3C4111.3°109.5°
N2C3H3108.9°109.4°
N2C3H3A108.9°109.4°
C4C3H3108.9°109.5°
C4C3H3A108.8°109.5°
C3C4C11111.8°109.4°
C3C4H4108.7°109.4°
C3C4H4A108.7°109.5°
H3C3H3A110.1°109.5°
C11C4H4108.7°109.4°
C11C4H4A108.7°109.5°
C4C11C12120.6°120.0°
C4C11C16119.1°120.0°
H4C4H4A110.2°109.5°
C2'N1'C5'112.8°104.2°
C2'N1'HN1'108.4°110.9°
N1'C2'C3'103.7°104.6°
N1'C2'H2'111.5°110.5°
N1'C2'H2'A111.4°110.4°
C5'N1'HN1'108.4°111.1°
N1'C5'C4'104.0°104.6°
N1'C5'H5'111.3°110.4°
N1'C5'H5'A111.3°110.4°
C12C11C16120.4°120.0°
C11C12C13119.1°120.0°
C11C12H12120.5°120.0°
C11C16C15120.2°120.1°
C11C16H16119.9°120.0°
C13C12H12120.5°120.0°
C12C13F13120.0°120.0°
C12C13C14120.8°119.9°
F13C13C14119.3°120.1°
C13C14C15119.9°120.0°
C13C14H14120.0°119.9°
C15C14H14120.1°120.0°
C14C15C16119.7°120.0°
C14C15H15120.2°120.0°
C16C15H15120.2°120.0°
C15C16H16119.9°120.0°
C21N11C61122.4°121.6°
N11C21C71120.0°119.5°
N11C21C31119.2°120.9°
N11C61C51120.3°120.6°
N11C61N61118.4°119.7°
C3'C2'H2'111.4°110.4°
C3'C2'H2'A111.5°110.4°
C2'C3'C4'104.3°105.0°
C2'C3'H3'115.3°110.3°
H2'C2'H2'A107.4°110.5°
C71C21C31120.8°119.6°
C21C71C4'113.5°109.5°
C21C71H71108.1°109.5°
C21C71H71A108.2°109.5°
C21C31C41119.8°119.3°
C21C31H31120.1°120.3°
C4'C3'H3'108.5°110.4°
C3'C4'C71112.2°110.3°
C3'C4'C5'100.9°105.1°
C3'C4'H4'114.7°110.3°
C41C31H31120.1°120.3°
C31C41C51120.5°118.5°
C31C41C81118.6°120.8°
C71C4'C5'113.3°110.3°
C71C4'H4'102.6°110.4°
C4'C71H71108.1°109.5°
C4'C71H71A108.1°109.4°
C5'C4'H4'113.6°110.4°
C4'C5'H5'111.3°110.4°
C4'C5'H5'A111.4°110.4°
C51C41C81120.9°120.7°
C41C51C61117.8°119.1°
C41C51H51121.1°120.5°
C41C81H81109.5°109.4°
C41C81H81A109.5°109.5°
C41C81H81B109.4°109.4°
H5'C5'H5'A107.5°110.5°
C61C51H51121.1°120.5°
C51C61N61121.3°119.7°
C61N61HN61109.5°120.0°
C61N61HN6A109.5°120.0°
HN61N61HN6A109.4°120.0°
H71C71H71A110.8°109.4°
H81C81H81A109.4°109.5°
H81C81H81B109.5°109.5°
H81AC81H81B109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N1C1C2H1120.0°120.0°
N1C1C2H1A120.0°120.1°
N1C1H1H1A119.4°120.0°
C1N1C3'HN1120.0°124.0°
N1C1C2N259.2°180.0°
N1C1C2H2179.2°60.0°
N1C1C2H2A60.8°59.9°
C1N1C3'C2'179.9°74.9°
C1N1C3'C4'61.4°169.4°
C1N1C3'H3'56.9°47.2°
C2C1H1H1A119.3°120.0°
C2C1N1C3'118.0°180.0°
C2C1N1HN1122.0°56.0°
C1C2N2H2120.0°120.0°
C1C2N2H2A120.0°120.1°
C1C2H2H2A118.3°120.0°
C1C2N2C3150.9°180.0°
C1C2N2HN289.1°56.1°
H1C1N1C3'122.0°60.0°
H1C1N1HN12.0°64.0°
H1C1C2N260.8°60.0°
H1C1C2H259.2°180.0°
H1C1C2H2A179.2°60.0°
H1AC1N1C3'2.0°59.9°
H1AC1N1HN1118.0°176.1°
H1AC1C2N2179.2°59.9°
H1AC1C2H260.8°60.0°
H1AC1C2H2A59.2°180.0°
N1C3'C2'N1'152.3°142.7°
N1C3'C2'C4'125.8°118.9°
N1C3'C2'H3'115.4°122.1°
N1C3'C2'H2'87.6°98.5°
N1C3'C2'H2'A32.4°23.9°
N1C3'C4'H3'115.1°122.2°
N1C3'C4'C7137.7°0.0°
N1C3'C4'C5'158.6°118.9°
N1C3'C4'H4'78.9°122.2°
HN1N1C3'C2'59.9°161.0°
HN1N1C3'C4'58.6°45.4°
HN1N1C3'H3'176.9°76.8°
N2C2H2H2A118.2°120.0°
C2N2C3HN2120.0°124.0°
C2N2C3C4170.2°180.0°
C2N2C3H369.7°60.0°
C2N2C3H3A50.3°60.0°
H2C2N2C330.9°60.0°
H2C2N2HN2150.9°176.0°
H2AC2N2C389.1°60.0°
H2AC2N2HN230.9°64.0°
N2C3C4H3120.0°120.0°
N2C3C4H3A120.0°119.9°
N2C3H3H3A119.2°119.9°
N2C3C4C11178.3°180.0°
N2C3C4H461.7°60.0°
N2C3C4H4A58.3°60.0°
HN2N2C3C450.2°56.0°
HN2N2C3H3170.3°176.1°
HN2N2C3H3A69.7°64.0°
C4C3H3H3A119.2°120.1°
C3C4C11H4120.0°119.9°
C3C4C11H4A120.0°120.0°
C3C4H4H4A119.1°120.0°
C3C4C11C1281.0°90.0°
C3C4C11C16100.3°90.3°
H3C3C4C1158.3°60.0°
H3C3C4H4178.3°180.0°
H3C3C4H4A61.7°60.0°
H3AC3C4C1161.7°60.0°
H3AC3C4H458.3°59.9°
H3AC3C4H4A178.3°180.0°
C11C4H4H4A119.0°120.1°
C4C11C12C16178.7°179.7°
C4C11C12C13179.4°180.0°
C4C11C12H120.6°0.1°
C4C11C16C15179.3°179.8°
C4C11C16H160.7°0.3°
H4C4C11C12159.0°29.9°
H4C4C11C1619.7°149.8°
H4AC4C11C1239.0°150.0°
H4AC4C11C16139.7°29.7°
C2'N1'C5'HN1'120.0°119.5°
N1'C2'C3'H2'120.0°118.8°
N1'C2'C3'H2'A120.0°118.8°
N1'C2'H2'H2'A122.4°122.4°
N1'C2'C3'C4'26.5°23.8°
N1'C2'C3'H3'92.3°95.1°
C2'N1'C5'C4'18.8°39.5°
C2'N1'C5'H5'138.8°79.3°
C2'N1'C5'H5'A101.2°158.2°
C5'N1'C2'C3'4.9°39.5°
C5'N1'C2'H2'124.9°158.2°
C5'N1'C2'H2'A115.1°79.3°
N1'C5'C4'C3'33.8°23.9°
N1'C5'C4'C7186.3°142.8°
N1'C5'C4'H5'120.0°118.8°
N1'C5'C4'H5'A120.0°118.7°
N1'C5'C4'H4'157.0°95.0°
N1'C5'H5'H5'A122.2°122.4°
HN1'N1'C2'C3'124.9°159.1°
HN1'N1'C2'H2'115.1°82.1°
HN1'N1'C2'H2'A4.9°40.4°
HN1'N1'C5'C4'101.2°159.0°
HN1'N1'C5'H5'18.8°40.3°
HN1'N1'C5'H5'A138.8°82.2°
C11C12C13H12180.0°179.9°
C11C12C13F13179.5°179.9°
C11C12C13C140.3°0.1°
C12C11C16C150.6°0.5°
C12C11C16H16179.4°180.0°
C16C11C12C130.7°0.3°
C16C11C12H12179.3°179.8°
C11C16C15C140.1°0.5°
C11C16C15H16180.0°179.5°
C11C16C15H15179.9°179.7°
C12C13F13C14179.8°179.9°
C12C13C14C150.2°0.0°
C12C13C14H14179.9°180.0°
H12C12C13F130.5°0.1°
H12C12C13C14179.7°180.0°
F13C13C14C15180.0°179.9°
F13C13C14H140.1°0.1°
C13C14C15H14180.0°180.0°
C13C14C15C160.3°0.3°
C13C14C15H15179.7°180.0°
C14C15C16H15180.0°179.8°
C14C15C16H16179.9°180.0°
H14C14C15C16179.8°179.7°
H14C14C15H150.2°0.0°
H15C15C16H160.1°0.3°
N11C21C71C31179.0°179.9°
N11C21C31C410.5°0.1°
N11C21C31H31179.5°179.9°
N11C21C71C4'92.4°55.0°
C21N11C61C511.2°0.0°
C21N11C61N61180.0°179.9°
N11C21C71H7127.5°65.1°
N11C21C71H71A147.6°174.9°
C61N11C21C71179.3°180.0°
C61N11C21C310.2°0.1°
N11C61C51C411.5°0.1°
N11C61C51N61178.8°179.9°
N11C61C51H51178.5°180.0°
N11C61N61HN610.0°0.0°
N11C61N61HN6A120.0°180.0°
C3'C2'H2'H2'A122.4°122.4°
C2'C3'C4'H3'123.3°118.9°
C2'C3'C4'C7183.8°118.9°
C2'C3'C4'C5'37.1°0.0°
C2'C3'C4'H4'159.6°118.9°
H2'C2'C3'C4'146.6°142.6°
H2'C2'C3'H3'27.8°23.7°
H2'AC2'C3'C4'93.4°94.9°
H2'AC2'C3'H3'147.8°146.1°
C21C71C4'C3'171.7°175.7°
C71C21C31C41178.6°180.0°
C71C21C31H311.4°0.0°
C21C71C4'H71120.0°120.1°
C21C71C4'H71A120.0°120.0°
C21C71C4'C5'58.3°68.6°
C21C71C4'H4'64.6°53.6°
C21C71H71H71A118.4°120.0°
C21C31C41H31180.0°180.0°
C31C21C71C4'86.6°124.9°
C21C31C41C510.1°0.0°
C21C31C41C81179.2°180.0°
C31C21C71H71153.4°115.0°
C31C21C71H71A33.4°5.0°
C3'C4'C71C5'113.5°115.6°
C3'C4'C71H4'123.6°122.2°
C3'C4'C5'H4'123.2°118.9°
C3'C4'C5'H5'153.8°94.9°
C3'C4'C5'H5'A86.2°142.6°
C3'C4'C71H7151.8°64.2°
C3'C4'C71H71A68.3°55.7°
H3'C3'C4'C71152.9°122.2°
H3'C3'C4'C5'86.2°119.0°
H3'C3'C4'H4'36.3°0.0°
C31C41C51C81179.3°180.0°
C31C41C51C610.9°0.1°
C31C41C51H51179.1°180.0°
C31C41C81H8190.4°90.0°
C31C41C81H81A149.7°150.0°
C31C41C81H81B29.7°30.0°
H31C31C41C51179.9°180.0°
H31C31C41C810.8°0.0°
C71C4'C5'H4'116.6°122.2°
C71C4'C5'H5'33.7°24.0°
C71C4'C5'H5'A153.7°98.5°
C4'C71H71H71A118.3°119.9°
C4'C5'H5'H5'A122.2°122.4°
C5'C4'C71H7161.7°51.4°
C5'C4'C71H71A178.3°171.4°
H4'C4'C5'H5'83.0°146.2°
H4'C4'C5'H5'A37.0°23.7°
H4'C4'C71H71175.4°173.6°
H4'C4'C71H71A55.4°66.4°
C41C51C61H51180.0°179.9°
C41C51C61N61179.7°180.0°
C51C41C81H8190.3°90.0°
C51C41C81H81A29.6°30.0°
C51C41C81H81B149.6°150.0°
C81C41C51C61179.9°179.9°
C81C41C51H510.1°0.0°
C41C81H81H81A120.0°120.0°
C41C81H81H81B120.0°119.9°
C41C81H81AH81B120.0°120.0°
C51C61N61HN61178.8°180.0°
C51C61N61HN6A58.8°0.0°
H51C51C61N610.3°0.1°
C61N61HN61HN6A120.0°180.0°
H81C81H81AH81B120.0°120.1°

223532

PDB entries from 2024-08-07

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