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R0I

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C10N10sing1.40Å1.39Å
C10C6Asing1.41Å1.39Å
C10C1Adoub1.40Å1.38Å
C11PTsing2.25Å1.80Å
C11N2sing1.40Å1.37Å
C11N3sing1.41Å1.31Å
C13C12doub1.37Å1.34Å
C13N3sing1.34Å1.39Å
C2C3doub1.43Å1.39Å
C2N1sing1.36Å1.36Å
C2C2Asing1.51Å1.39Å
C3C4sing1.36Å1.39Å
C4C4Adoub1.41Å1.39Å
C5C6doub1.34Å1.39Å
C5C4Asing1.43Å1.40Å
C6C6Asing1.43Å1.39Å
C8C9doub1.43Å1.39Å
C8C7sing1.36Å1.39Å
C12N2sing1.37Å1.35Å
C12C19sing1.46Å1.55Å
C9AC9sing1.52Å1.39Å
C9N10sing1.37Å1.35Å
C7C6Adoub1.40Å1.39Å
N10PTsing2.01Å1.82Å
C1AC4Asing1.41Å1.40Å
C1AN1sing1.40Å1.38Å
N1PTsing2.00Å1.82Å
PTC17sing2.06Å2.10Å
PTC18sing2.06Å2.10Å
N2C14sing1.46Å1.39Å
N3C15sing1.47Å1.39Å
C17C18doub1.37Å1.49Å
C19C20doub1.39Å1.35ÅAromatic
C19N6sing1.36Å1.36ÅAromatic
C20N5sing1.35Å1.35ÅAromatic
N6N4sing1.34Å1.34ÅAromatic
N4N5doub1.35Å1.34ÅAromatic
PTCPsing2.16Å2.80Å
C13H1sing0.94Å1.08Å
C3H2sing0.94Å1.08Å
C4H3sing0.94Å1.08Å
C5H4sing0.94Å1.08Å
C6H5sing0.94Å1.08Å
C8H6sing0.94Å1.08Å
C9AH7sing0.97Å1.10Å
C9AH8sing0.97Å1.10Å
C9AH9sing0.97Å1.10Å
C7H10sing0.94Å1.08Å
C2AH11sing0.97Å1.10Å
C2AH12sing0.97Å1.10Å
C2AH13sing0.97Å1.10Å
CPH14sing0.95Å1.10Å
CPH15sing0.94Å1.10Å
CPH16sing0.94Å1.10Å
C14H17sing0.97Å1.10Å
C14H18sing0.96Å1.10Å
C14H19sing0.97Å1.10Å
C15H20sing0.97Å1.10Å
C15H21sing0.97Å1.10Å
C15H22sing0.97Å1.10Å
C20H27sing0.94Å1.08Å
N6H28sing0.88Å1.00Å
C17H23sing0.98Å1.10Å
C18H24sing0.98Å1.10Å
H25C17sing0.98Å1.10Å
H26C18sing0.96Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N10C10C6A126.9°121.4°
N10C10C1A113.5°118.6°
C10N10C9114.8°116.9°
C10N10PT114.2°103.9°
C6AC10C1A119.6°119.9°
C10C6AC6120.1°119.3°
C10C6AC7116.4°118.6°
C10C1AC4A120.0°120.1°
C10C1AN1111.4°118.6°
PTC11N2134.0°126.6°
PTC11N3129.5°128.2°
C11PTN1086.3°83.2°
C11PTN188.0°101.1°
C11PTC1784.9°139.1°
C11PTC1885.8°110.6°
C11PTCP174.4°67.2°
N2C11N396.5°103.4°
C11N2C12117.9°110.7°
C11N2C14124.6°123.3°
C11N3C13117.8°109.7°
C11N3C15124.3°128.1°
C12C13N3104.2°109.7°
C13C12N2103.6°106.4°
C13C12C19121.2°121.0°
C12C13H1127.9°126.5°
C13N3C15117.9°122.2°
N3C13H1127.9°123.7°
C3C2N1121.8°120.6°
C3C2C2A117.1°119.2°
C2C3C4124.2°120.2°
C2C3H2117.9°119.9°
N1C2C2A121.0°120.1°
C2N1C1A112.5°118.9°
C2N1PT131.4°134.0°
C2C2AH11109.5°109.5°
C2C2AH12109.4°110.1°
C2C2AH13109.5°109.5°
C3C4C4A115.5°120.0°
C4C3H2117.9°119.9°
C3C4H3122.2°120.0°
C4C4AC5121.6°122.0°
C4C4AC1A117.3°118.7°
C4AC4H3122.2°120.0°
C6C5C4A118.2°120.7°
C5C6C6A121.0°120.7°
C6C5H4120.9°119.8°
C5C6H5119.5°119.7°
C5C4AC1A121.1°119.2°
C4AC5H4120.9°119.5°
C6C6AC7123.6°122.1°
C6AC6H5119.5°119.5°
C9C8C7123.0°119.6°
C8C9C9A118.4°118.2°
C8C9N10121.1°120.3°
C9C8H6118.5°120.2°
C8C7C6A117.8°119.7°
C7C8H6118.5°120.2°
C8C7H10121.1°120.1°
N2C12C19135.3°132.6°
C12N2C14117.4°126.0°
C12C19C20126.2°127.3°
C12C19N6125.7°128.7°
C9AC9N10120.4°121.5°
C9C9AH7109.5°109.8°
C9C9AH8109.4°110.0°
C9C9AH9109.5°109.4°
C9N10PT130.6°138.9°
C6AC7H10121.1°120.2°
N10PTN184.4°85.8°
N10PTC17149.6°126.5°
N10PTC18108.9°109.0°
N10PTCP99.3°148.3°
C4AC1AN1128.6°121.2°
C1AN1PT116.0°104.9°
N1PTC17124.2°107.9°
N1PTC18164.9°146.2°
N1PTCP93.1°110.0°
C17PTC1841.5°38.8°
PTC17C1869.3°70.4°
C17PTCP89.9°76.0°
PTC17H23118.4°60.9°
PTC17H25118.4°145.7°
PTC18C1769.2°70.7°
C18PTCP91.7°73.5°
PTC18H24118.4°146.5°
PTC18H26118.3°58.0°
N2C14H17109.5°109.1°
N2C14H18109.5°111.2°
N2C14H19109.5°109.0°
N3C15H20109.5°109.2°
N3C15H21109.5°110.5°
N3C15H22109.5°109.5°
C18C17H23118.4°119.7°
C17C18H24118.4°121.7°
C18C17H25118.4°121.1°
C17C18H26118.4°118.4°
C20C19N6108.1°104.0°
C19C20N5105.8°109.7°
C19C20H27127.1°125.6°
C19N6N4109.0°110.9°
C19N6H28125.5°129.2°
C20N5N4111.1°107.7°
N5C20H27127.1°124.7°
N6N4N5106.0°107.7°
N4N6H28125.5°120.0°
PTCPH14109.5°111.3°
PTCPH15109.5°114.5°
PTCPH16109.5°110.9°
H7C9AH8109.5°109.1°
H7C9AH9109.4°109.3°
H8C9AH9109.5°109.1°
H11C2AH12109.5°109.1°
H11C2AH13109.5°109.3°
H12C2AH13109.5°109.3°
H14CPH15109.5°107.2°
H14CPH16109.5°108.0°
H15CPH16109.4°104.6°
H17C14H18109.5°109.2°
H17C14H19109.4°109.2°
H18C14H19109.5°109.2°
H20C15H21109.4°109.1°
H20C15H22109.4°109.1°
H21C15H22109.5°109.5°
H23C17H25109.5°119.1°
H24C18H26109.5°119.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N10C10C6AC1A178.7°175.2°
C10N10PTC1182.7°76.8°
N10C10C6AC6179.5°177.8°
C10N10C9C81.8°21.9°
C10N10C9C9A179.9°160.4°
C10N10C9PT172.3°173.0°
N10C10C6AC71.7°2.1°
N10C10C1AC4A180.0°178.7°
N10C10C1AN10.3°4.9°
C10N10PTN15.7°24.9°
C10N10PTC17156.0°134.1°
C10N10PTC18167.0°173.7°
C10N10PTCP97.9°97.2°
C10C6AC6C51.5°0.6°
C10C6AC6C7177.7°179.9°
C10C6AC7C82.1°9.7°
C6AC10N10C90.4°13.6°
C6AC10N10PT174.0°161.7°
C6AC10C1AC4A1.2°3.3°
C6AC10C1AN1178.5°179.7°
C10C6AC6H5178.5°179.1°
C10C6AC7H10177.9°170.2°
C10C1AN1C2179.1°178.1°
C10C1AC4AC4179.9°177.7°
C10C1AC4AC50.2°2.0°
C1AC10C6AC61.8°2.6°
C1AC10N10C9178.4°161.7°
C1AC10C6AC7179.7°177.3°
C1AC10N10PT4.8°23.0°
C10C1AC4AN1179.6°176.3°
C10C1AN1PT4.3°16.4°
PTC11N2N3179.2°165.9°
PTC11N3C13178.9°163.7°
C11PTN1C295.0°102.8°
PTC11N2C12179.2°164.3°
C11PTN10C989.7°96.8°
C11PTN10N188.4°101.7°
C11PTN10C1773.3°149.1°
C11PTN10C1884.3°109.5°
C11PTN10CP179.4°20.4°
C11PTN1C1A80.8°59.4°
C11PTN1C1782.4°150.8°
C11PTN1C1865.9°159.4°
C11PTN1CP174.5°69.5°
C11PTC17C1889.5°54.7°
C11PTC17CP177.8°26.1°
C11PTC18CP174.9°57.0°
PTC11N2C140.6°15.5°
PTC11N3C150.0°15.2°
C11PTCPH14180.0°60.3°
C11PTCPH1560.0°178.0°
C11PTCPH1660.0°59.9°
C11PTC17H2322.4°162.1°
C11PTC18H24161.1°26.4°
C11PTC17H25158.6°62.2°
C11PTC18H2624.9°70.4°
C11N2C12C130.7°0.8°
N2C11N3C131.9°1.9°
C11N2C12C14178.7°179.7°
C11N2C12C19178.9°178.3°
N2C11PTN10133.6°62.1°
N2C11PTN149.1°146.4°
N2C11PTC1775.5°78.8°
N2C11PTC18117.2°45.7°
N2C11N3C15179.3°179.2°
N2C11PTCP52.3°106.4°
C11N2C14H17180.0°128.1°
C11N2C14H1860.0°7.6°
C11N2C14H1960.0°112.8°
C11N3C13C121.7°1.5°
C11N3C13C15178.9°179.0°
N3C11N2C121.6°1.6°
N3C11PTN1045.4°100.4°
N3C11PTN1129.9°16.1°
N3C11PTC17105.5°118.7°
N3C11PTC1863.9°151.9°
N3C11N2C14179.8°178.6°
N3C11PTCP128.7°91.1°
C11N3C13H1178.4°178.9°
C11N3C15H20180.0°137.7°
C11N3C15H2160.0°17.7°
C11N3C15H2260.0°102.9°
C12C13N3H1180.0°179.5°
C13C12N2C19179.6°179.1°
C13C12N2C14179.4°179.5°
C12C13N3C15179.4°179.5°
C13C12C19C200.4°1.5°
C13C12C19N6179.9°178.8°
N3C13C12N20.5°0.5°
N3C13C12C19179.8°179.7°
C13N3C15H201.2°43.5°
C13N3C15H21118.8°163.5°
C13N3C15H22121.2°75.9°
C3C2N1C2A179.9°178.3°
C2C3C4H2180.0°179.9°
C2C3C4C4A0.8°1.0°
C3C2N1C1A1.2°6.4°
C3C2N1PT174.7°154.0°
C2C3C4H3179.2°179.0°
C3C2C2AH11180.0°135.1°
C3C2C2AH1260.0°15.2°
C3C2C2AH1360.0°105.0°
N1C2C3C40.2°3.2°
C2N1PTN10178.5°175.0°
C2N1C1AC4A1.2°5.5°
C2N1C1APT176.6°165.5°
C2N1PTC1712.5°47.9°
C2N1PTC1829.0°56.6°
C2N1PTCP79.5°33.3°
N1C2C3H2179.8°176.7°
N1C2C2AH110.1°46.6°
N1C2C2AH12120.1°166.5°
N1C2C2AH13119.9°73.3°
C2AC2C3C4179.7°178.5°
C2AC2N1C1A178.7°175.4°
C2AC2N1PT5.4°24.3°
C2AC2C3H20.3°1.6°
C2C2AH11H12120.0°120.5°
C2C2AH11H13120.0°120.0°
C2C2AH12H13120.0°120.3°
C3C4C4AH3180.0°180.0°
C3C4C4AC5179.5°178.4°
C3C4C4AC1A0.8°1.9°
C4C4AC5C6179.6°179.8°
C4C4AC5C1A179.7°179.8°
C4C4AC1AN10.3°1.4°
C4AC4C3H2179.2°179.1°
C4C4AC5H40.4°0.7°
C6C5C4AH4180.0°179.5°
C5C6C6AH5180.0°179.7°
C5C6C6AC7179.2°179.3°
C6C5C4AC1A0.1°0.0°
C4AC5C6C6A0.5°0.7°
C5C4AC1AN1179.5°178.4°
C5C4AC4H30.5°1.6°
C4AC5C6H5179.5°179.6°
C6C6AC7C8179.9°170.2°
C6AC6C5H4179.4°179.8°
C6C6AC7H100.1°9.9°
C9C8C7H6180.0°179.5°
C8C9C9AN10178.1°177.8°
C9C8C7C6A0.8°1.6°
C8C9N10PT174.1°151.2°
C8C9C9AH7180.0°100.3°
C8C9C9AH860.0°19.8°
C8C9C9AH960.0°139.7°
C9C8C7H10179.2°178.3°
C7C8C9C9A179.4°167.4°
C7C8C9N101.3°14.8°
C8C7C6AH10180.0°179.9°
N2C12C19C20180.0°177.5°
N2C12C19N60.4°2.2°
N2C12C13H1179.5°180.0°
C12N2C14H171.4°51.7°
C12N2C14H18121.4°172.1°
C12N2C14H19118.6°67.4°
C19C12N2C140.2°1.4°
C12C19C20N6179.7°179.8°
C12C19C20N5179.8°179.8°
C12C19N6N4179.6°179.8°
C19C12C13H10.2°0.8°
C12C19C20H270.2°0.1°
C12C19N6H280.4°0.3°
C9AC9N10PT7.8°26.6°
C9AC9C8H60.6°13.1°
C9C9AH7H8120.0°120.6°
C9C9AH7H9120.0°120.0°
C9C9AH8H9120.0°120.0°
C9N10PTN1178.0°161.5°
C9N10PTC1716.3°52.3°
C9N10PTC185.3°12.7°
C9N10PTCP89.8°76.3°
N10C9C8H6178.7°164.8°
N10C9C9AH71.9°77.5°
N10C9C9AH8118.1°162.4°
N10C9C9AH9121.9°42.5°
C7C6AC6H50.8°1.0°
C6AC7C8H6179.2°178.9°
N10PTN1C1A5.7°22.8°
N10PTN1C17168.9°127.0°
N10PTN1C18152.4°118.4°
N10PTN1CP99.1°151.7°
N10PTC17C1815.8°74.2°
N10PTC17CP108.6°155.0°
N10PTC18CP100.5°146.7°
N10PTCPH145.9°38.2°
N10PTCPH15114.1°159.9°
N10PTCPH16125.9°82.0°
N10PTC17H2396.1°69.0°
N10PTC18H2476.5°116.1°
N10PTC17H25127.7°168.9°
N10PTC18H2659.7°19.3°
C4AC1AN1PT175.3°160.0°
C1AC4AC4H3179.2°178.1°
C1AC4AC5H4179.9°179.5°
C1AN1PTC17163.2°149.8°
C1AN1PTC18146.7°141.2°
C1AN1PTCP104.8°129.0°
N1PTC17C18173.6°172.3°
N1PTC17CP93.7°106.8°
N1PTC18CP108.7°101.3°
N1PTCPH1478.9°154.2°
N1PTCPH15161.1°84.0°
N1PTCPH1641.1°34.0°
N1PTC17H2361.7°29.2°
N1PTC18H24132.7°131.9°
N1PTC17H2574.5°70.8°
N1PTC18H2691.1°131.2°
C17PTC18CP87.9°88.2°
PTC17C18H23111.9°37.1°
PTC17C18H25111.9°144.1°
C17PTCPH14156.9°101.5°
C17PTCPH1536.8°20.2°
C17PTCPH1683.1°138.3°
PTC17H23H25139.8°140.6°
C17PTC18H24111.9°118.8°
PTC17C18H26111.9°34.2°
C18PTCPH14115.4°61.3°
C18PTCPH154.6°60.5°
C18PTCPH16124.6°178.5°
PTC18H24H26139.8°76.1°
N2C14H17H18120.0°121.7°
N2C14H17H19120.0°119.0°
N2C14H18H19120.0°120.3°
C15N3C13H10.5°0.1°
N3C15H20H21120.0°120.9°
N3C15H20H22120.0°119.6°
N3C15H21H22120.0°120.6°
C18C17H23H25139.8°178.8°
C17C18H24H26139.8°179.5°
C19C20N5H27180.0°179.9°
C20C19N6N40.1°0.0°
C19C20N5N40.3°0.0°
C20C19N6H28179.9°179.9°
N6C19C20N50.1°0.0°
C19N6N4H28180.0°179.9°
C19N6N4N50.3°0.1°
N6C19C20H27179.9°179.9°
C20N5N4N60.4°0.0°
N4N5C20H27179.7°179.9°
N5N4N6H28179.7°180.0°
PTCPH14H15120.0°125.9°
PTCPH14H16120.0°121.9°
PTCPH15H16120.0°121.5°
CPPTC17H23155.4°136.0°
CPPTC18H2424.0°30.6°
CPPTC17H2519.2°36.1°
CPPTC18H26160.2°127.4°
H2C3C4H30.8°0.9°
H4C5C6H50.6°0.1°
H6C8C7H100.8°1.3°
H7C9AH8H9120.0°119.4°
H11C2AH12H13120.0°119.5°
H14CPH15H16120.0°114.5°
H17C14H18H19120.0°119.3°
H20C15H21H22120.0°119.3°
H23C17C18H24136.2°177.5°
H23C17C18H260.0°3.0°
H24C18C17H250.0°1.3°
H25C17C18H26136.3°178.2°

260320

PDB entries from 2026-09-30

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