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D38

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C2C1doub1.40Å1.40ÅAromatic
C1C6sing1.38Å1.40ÅAromatic
C1H1sing1.08Å1.08Å
C7C2sing1.48Å1.51Å
C2C3sing1.40Å1.40ÅAromatic
C3C4doub1.38Å1.39ÅAromatic
C3H3sing1.08Å1.08Å
C4C5sing1.38Å1.40ÅAromatic
C4H4sing1.08Å1.08Å
C6C5doub1.38Å1.40ÅAromatic
C5C10sing1.51Å1.51Å
C6H6sing1.08Å1.08Å
O8C7doub1.21Å1.27Å
O9C7sing1.35Å1.27Å
O9HO9sing0.97Å0.95Å
C10N11sing1.47Å1.45Å
C10H10sing1.09Å1.10Å
C10H10Asing1.09Å1.10Å
C12N11sing1.35Å1.37ÅAromatic
N11N15sing1.29Å1.35ÅAromatic
C12C13doub1.35Å1.38ÅAromatic
C12H12sing1.08Å1.08Å
C16C13sing1.51Å1.49Å
C13N14sing1.34Å1.37ÅAromatic
N14N15doub1.29Å1.33ÅAromatic
C16C17sing1.53Å1.53Å
C16H16sing1.09Å1.10Å
C16H16Asing1.09Å1.10Å
C18C17sing1.53Å1.52Å
C17C21sing1.51Å1.52Å
C17H17sing1.09Å1.10Å
C20C18sing1.53Å1.52Å
C18C19sing1.53Å1.52Å
C18H18sing1.09Å1.10Å
C19H19sing1.09Å1.10Å
C19H19Asing1.09Å1.10Å
C19H19Bsing1.09Å1.10Å
C20H20sing1.09Å1.10Å
C20H20Asing1.09Å1.10Å
C20H20Bsing1.09Å1.10Å
C21N22sing1.35Å1.38Å
C21O27doub1.21Å1.23Å
N22C23sing1.47Å1.48Å
N22HN22sing0.97Å1.00Å
C23C28sing1.53Å1.53Å
C23C24sing1.51Å1.56Å
C23H23sing1.09Å1.10Å
O25C24doub1.21Å1.27Å
C24O26sing1.34Å1.27Å
O26HO26sing0.97Å0.95Å
C28C29sing1.53Å1.53Å
C28H28sing1.09Å1.10Å
C28H28Asing1.09Å1.10Å
C29C30sing1.53Å1.53Å
C29H29sing1.09Å1.10Å
C29H29Asing1.09Å1.10Å
C30C31sing1.53Å1.52Å
C30H30sing1.09Å1.10Å
C30H30Asing1.09Å1.10Å
C31N32sing1.47Å1.47Å
C31H31sing1.09Å1.10Å
C31H31Asing1.09Å1.10Å
N32HN32sing1.01Å1.00Å
N32HN3Asing1.01Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C6121.9°119.9°
C2C1H1119.1°120.1°
C1C2C7123.4°120.2°
C1C2C3117.6°119.7°
C6C1H1119.0°120.1°
C1C6C5120.1°120.2°
C1C6H6119.9°119.9°
C7C2C3119.0°120.1°
C2C7O8115.7°120.0°
C2C7O9119.3°120.0°
C2C3C4120.6°119.9°
C2C3H3119.6°120.1°
C4C3H3119.7°120.0°
C3C4C5121.5°120.1°
C3C4H4119.3°120.0°
C5C4H4119.2°119.9°
C4C5C6118.2°120.3°
C4C5C10119.2°119.9°
C6C5C10122.6°119.8°
C5C6H6119.9°120.0°
C5C10N11112.7°109.4°
C5C10H10108.4°109.5°
C5C10H10A108.4°109.5°
O8C7O9125.0°120.0°
C7O9HO9109.5°117.0°
N11C10H10108.4°109.5°
N11C10H10A108.4°109.4°
C10N11C12129.2°125.9°
C10N11N15118.4°125.9°
H10C10H10A110.5°109.5°
C12N11N15111.0°108.2°
N11C12C13104.5°106.2°
N11C12H12127.8°126.9°
N11N15N14107.0°110.2°
C13C12H12127.7°126.9°
C12C13C16130.9°126.7°
C12C13N14108.3°106.5°
C16C13N14120.0°126.8°
C13C16C17120.2°109.5°
C13C16H16106.0°109.5°
C13C16H16A106.1°109.5°
C13N14N15109.1°108.9°
C17C16H16106.0°109.5°
C17C16H16A106.0°109.5°
C16C17C18121.6°109.5°
C16C17C21116.1°109.5°
C16C17H1796.1°109.5°
H16C16H16A112.7°109.5°
C18C17C21118.4°109.5°
C18C17H1790.1°109.4°
C17C18C20118.3°109.5°
C17C18C19115.1°109.4°
C17C18H1898.4°109.5°
C21C17H17104.0°109.5°
C17C21N22113.6°120.0°
C17C21O27125.1°120.0°
C20C18C19110.8°109.5°
C20C18H18104.0°109.5°
C18C20H20109.5°109.5°
C18C20H20A109.4°109.5°
C18C20H20B109.4°109.4°
C19C18H18108.4°109.5°
C18C19H19109.5°109.5°
C18C19H19A109.5°109.4°
C18C19H19B109.4°109.4°
H19C19H19A109.4°109.5°
H19C19H19B109.5°109.5°
H19AC19H19B109.5°109.5°
H20C20H20A109.5°109.5°
H20C20H20B109.5°109.5°
H20AC20H20B109.5°109.5°
N22C21O27121.1°120.0°
C21N22C23123.4°120.0°
C21N22HN22118.3°120.1°
C23N22HN22118.3°119.9°
N22C23C28111.5°109.5°
N22C23C24109.9°109.5°
N22C23H23107.1°109.4°
C28C23C24107.3°109.5°
C28C23H23109.8°109.4°
C23C28C29114.7°109.5°
C23C28H28107.7°109.4°
C23C28H28A107.8°109.5°
C24C23H23111.3°109.4°
C23C24O25114.2°120.0°
C23C24O26116.9°120.0°
O25C24O26128.9°120.0°
C24O26HO26109.5°117.0°
C29C28H28107.8°109.5°
C29C28H28A107.7°109.5°
C28C29C30109.3°109.4°
C28C29H29109.6°109.5°
C28C29H29A109.6°109.5°
H28C28H28A111.2°109.5°
C30C29H29109.5°109.4°
C30C29H29A109.6°109.4°
C29C30C31112.4°109.5°
C29C30H30108.5°109.4°
C29C30H30A108.5°109.5°
H29C29H29A109.4°109.5°
C31C30H30108.5°109.4°
C31C30H30A108.5°109.5°
C30C31N32106.3°109.4°
C30C31H31110.5°109.4°
C30C31H31A110.5°109.5°
H30C30H30A110.4°109.5°
N32C31H31110.5°109.4°
N32C31H31A110.6°109.5°
C31N32HN32109.5°111.0°
C31N32HN3A109.5°111.0°
H31C31H31A108.4°109.5°
HN32N32HN3A109.4°111.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C6H1180.0°179.8°
C1C2C7C3178.0°180.0°
C1C2C3C40.7°0.0°
C1C2C3H3179.4°180.0°
C2C1C6C50.4°0.0°
C2C1C6H6179.5°179.7°
C1C2C7O8175.6°0.0°
C1C2C7O95.0°180.0°
C6C1C2C7177.9°180.0°
C6C1C2C30.1°0.0°
C1C6C5C40.4°0.0°
C1C6C5H6180.0°179.7°
C1C6C5C10179.1°179.9°
H1C1C2C72.1°0.3°
H1C1C2C3179.9°179.7°
H1C1C6C5179.6°179.7°
H1C1C6H60.4°0.1°
C7C2C3C4177.5°180.0°
C7C2C3H32.5°0.0°
C2C7O8O9179.3°180.0°
C2C7O9HO9179.3°179.9°
C2C3C4H3180.0°180.0°
C2C3C4C50.7°0.0°
C2C3C4H4179.3°180.0°
C3C2C7O86.4°180.0°
C3C2C7O9173.0°0.0°
C3C4C5H4180.0°180.0°
C3C4C5C60.1°0.0°
C3C4C5C10179.6°179.9°
H3C3C4C5179.3°180.0°
H3C3C4H40.7°0.0°
C4C5C6C10179.5°179.9°
C4C5C6H6179.6°179.7°
C4C5C10N11160.1°90.0°
C4C5C10H1080.0°150.0°
C4C5C10H10A40.1°29.9°
H4C4C5C6179.9°180.0°
H4C4C5C100.4°0.1°
C6C5C10N1119.4°90.1°
C6C5C10H10100.6°29.9°
C6C5C10H10A139.4°150.0°
C10C5C6H60.9°0.4°
C5C10N11H10120.0°120.1°
C5C10N11H10A120.0°119.9°
C5C10H10H10A118.7°120.1°
C5C10N11C1291.3°125.3°
C5C10N11N1574.0°55.0°
O8C7O9HO90.0°0.0°
N11C10H10H10A118.6°119.9°
C10N11C12N15166.1°179.7°
C10N11C12C13166.3°180.0°
C10N11C12H1213.7°0.0°
C10N11N15N14168.3°179.8°
H10C10N11C12148.7°5.3°
H10C10N11N1546.0°175.0°
H10AC10N11C1228.7°114.7°
H10AC10N11N15166.0°65.0°
N11C12C13H12180.0°179.9°
N11C12C13C16170.0°180.0°
N11C12C13N140.2°0.0°
C12N11N15N140.5°0.5°
N15N11C12C130.2°0.3°
N15N11C12H12179.8°179.8°
N11N15N14C130.6°0.5°
C12C13C16N14169.2°180.0°
C12C13N14N150.5°0.3°
C12C13C16C1789.6°123.7°
C12C13C16H1630.4°116.3°
C12C13C16H16A150.4°3.7°
H12C12C13C1610.0°0.0°
H12C12C13N14179.8°179.9°
C16C13N14N15170.9°179.7°
C13C16C17H16120.0°120.0°
C13C16C17H16A120.0°120.0°
C13C16H16H16A115.6°120.0°
C13C16C17C18148.8°66.4°
C13C16C17C2153.9°173.5°
C13C16C17H1754.9°53.5°
N14C13C16C17101.2°56.3°
N14C13C16H16138.8°63.7°
N14C13C16H16A18.8°176.3°
C17C16H16H16A115.5°120.0°
C16C17C18C21156.8°120.0°
C16C17C18H1797.3°120.0°
C16C17C21H17104.1°120.1°
C16C17C18C2026.9°173.8°
C16C17C18C19161.1°66.3°
C16C17C18H1884.1°53.8°
C16C17C21N22102.6°168.2°
C16C17C21O2783.8°11.9°
H16C16C17C1828.8°53.6°
H16C16C17C21173.9°66.4°
H16C16C17H1765.1°173.5°
H16AC16C17C1891.1°173.6°
H16AC16C17C2166.1°53.6°
H16AC16C17H17174.9°66.4°
C18C17C21H1797.9°119.9°
C17C18C20C19136.0°120.0°
C17C18C20H18107.7°120.0°
C17C18C19H18108.9°120.0°
C17C18C19H19180.0°62.9°
C17C18C19H19A60.0°177.0°
C17C18C19H19B60.0°57.0°
C17C18C20H20180.0°59.5°
C17C18C20H20A60.0°179.5°
C17C18C20H20B60.0°60.5°
C18C17C21N2299.4°71.8°
C18C17C21O2774.2°108.1°
C21C17C18C20129.9°66.2°
C21C17C18C194.4°53.8°
C21C17C18H18119.2°173.8°
C17C21N22O27173.9°179.9°
C17C21N22C23177.0°175.0°
C17C21N22HN223.0°4.9°
H17C17C18C20124.1°53.7°
H17C17C18C19101.6°173.7°
H17C17C18H1813.2°66.3°
H17C17C21N221.5°48.1°
H17C17C21O27172.1°131.9°
C20C18C19H18113.5°120.0°
C20C18C19H1942.4°57.0°
C20C18C19H19A77.5°63.0°
C20C18C19H19B162.4°177.0°
C18C20H20H20A120.0°120.0°
C18C20H20H20B120.0°120.0°
C18C20H20AH20B120.0°119.9°
C18C19H19H19A120.0°120.0°
C18C19H19H19B120.0°120.0°
C18C19H19AH19B120.0°119.9°
C19C18C20H2044.0°179.5°
C19C18C20H20A164.0°60.5°
C19C18C20H20B76.0°59.5°
H18C18C19H1971.1°177.1°
H18C18C19H19A168.9°57.0°
H18C18C19H19B48.9°62.9°
H18C18C20H2072.2°60.5°
H18C18C20H20A47.8°59.5°
H18C18C20H20B167.7°179.5°
H19C19H19AH19B120.0°120.0°
H20C20H20AH20B120.0°120.0°
C21N22C23HN22180.0°179.9°
C21N22C23C28179.6°154.9°
C21N22C23C2461.5°85.0°
C21N22C23H2359.5°35.0°
O27C21N22C233.1°5.1°
O27C21N22HN22176.9°175.0°
N22C23C28C24120.4°120.1°
N22C23C28H23118.5°120.0°
N22C23C24H23118.5°119.9°
N22C23C24O2553.5°0.1°
N22C23C24O26126.6°180.0°
N22C23C28C29156.2°64.9°
N22C23C28H2883.8°55.0°
N22C23C28H28A36.2°175.0°
HN22N22C23C280.4°25.0°
HN22N22C23C24118.4°95.1°
HN22N22C23H23120.5°145.0°
C28C23C24H23120.1°120.0°
C28C23C24O2567.9°120.0°
C28C23C24O26112.1°59.9°
C23C28C29H28120.0°119.9°
C23C28C29H28A120.0°120.1°
C23C28H28H28A117.8°120.0°
C23C28C29C3065.6°180.0°
C23C28C29H29174.4°60.1°
C23C28C29H29A54.5°60.0°
C23C24O25O26179.9°179.9°
C23C24O26HO26179.9°179.9°
C24C23C28C2935.8°175.0°
C24C23C28H28155.8°65.1°
C24C23C28H28A84.2°54.9°
H23C23C24O25172.0°120.0°
H23C23C24O268.1°60.0°
H23C23C28C2985.3°55.0°
H23C23C28H2834.7°175.0°
H23C23C28H28A154.7°65.1°
O25C24O26HO260.0°0.0°
C29C28H28H28A117.8°120.1°
C28C29C30H29120.0°120.0°
C28C29C30H29A120.0°120.0°
C28C29H29H29A120.1°120.1°
C28C29C30C31153.3°180.0°
C28C29C30H3086.7°60.0°
C28C29C30H30A33.3°60.0°
H28C28C29C3054.4°60.1°
H28C28C29H2965.6°180.0°
H28C28C29H29A174.4°59.9°
H28AC28C29C30174.4°60.0°
H28AC28C29H2954.4°60.0°
H28AC28C29H29A65.5°180.0°
C30C29H29H29A120.1°120.0°
C29C30C31H30120.0°119.9°
C29C30C31H30A120.0°120.0°
C29C30H30H30A118.8°120.0°
C29C30C31N32139.6°180.0°
C29C30C31H3119.6°60.1°
C29C30C31H31A100.4°59.9°
H29C29C30C3133.3°60.0°
H29C29C30H30153.3°180.0°
H29C29C30H30A86.7°60.0°
H29AC29C30C3186.7°60.0°
H29AC29C30H3033.3°60.0°
H29AC29C30H30A153.3°180.0°
C31C30H30H30A118.8°120.0°
C30C31N32H31120.0°119.9°
C30C31N32H31A120.0°120.1°
C30C31H31H31A121.3°120.0°
C30C31N32HN32180.0°56.0°
C30C31N32HN3A60.0°180.0°
H30C30C31N32100.4°60.1°
H30C30C31H31139.7°180.0°
H30C30C31H31A19.6°60.0°
H30AC30C31N3219.6°60.0°
H30AC30C31H31100.3°60.0°
H30AC30C31H31A139.6°180.0°
N32C31H31H31A121.3°120.1°
C31N32HN32HN3A120.0°124.0°
H31C31N32HN3260.1°63.9°
H31C31N32HN3A180.0°60.1°
H31AC31N32HN3260.0°176.1°
H31AC31N32HN3A60.0°60.0°

225946

PDB entries from 2024-10-09

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