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LHL

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1C2doub1.32Å1.36ÅAromatic
N1C10sing1.33Å1.33ÅAromatic
C2N2sing1.38Å1.43Å
C2N3sing1.33Å1.35ÅAromatic
N2C21sing1.40Å1.45Å
N3C4doub1.33Å1.34ÅAromatic
C4N5sing1.38Å1.42Å
C4C9sing1.40Å1.38ÅAromatic
C5N5sing1.46Å1.47Å
N5C6sing1.34Å1.41Å
C6O6doub1.22Å1.24Å
C6N7sing1.35Å1.41Å
N7C8sing1.47Å1.48Å
N7C71sing1.40Å1.45Å
C8C9sing1.51Å1.50Å
C9C10doub1.37Å1.37ÅAromatic
C21C22doub1.39Å1.40ÅAromatic
C21C26sing1.39Å1.40ÅAromatic
C22C23sing1.38Å1.38ÅAromatic
C23C24doub1.39Å1.39ÅAromatic
C24O24sing1.36Å1.39Å
C24C25sing1.39Å1.40ÅAromatic
O24C27sing1.43Å1.43Å
C25C26doub1.38Å1.40ÅAromatic
C27C28sing1.53Å1.54Å
C28N28sing1.47Å1.49Å
N28C29sing1.47Å1.48Å
N28C31sing1.47Å1.48Å
C29C30sing1.53Å1.54Å
C31C32sing1.53Å1.54Å
C71C72doub1.39Å1.40ÅAromatic
C71C76sing1.39Å1.41ÅAromatic
C72CL72sing1.74Å1.75Å
C72C73sing1.38Å1.40ÅAromatic
C73C74doub1.38Å1.40ÅAromatic
C74C75sing1.38Å1.40ÅAromatic
C75C76doub1.38Å1.40ÅAromatic
C76CL76sing1.74Å1.73Å
N2HN2sing0.97Å1.00Å
C5H5sing1.09Å1.10Å
C5H5Asing1.09Å1.10Å
C5H5Bsing1.09Å1.10Å
C8H8sing1.09Å1.10Å
C8H8Asing1.09Å1.10Å
C10H10sing1.08Å1.08Å
C22H22sing1.08Å1.08Å
C23H23sing1.08Å1.08Å
C25H25sing1.08Å1.08Å
C26H26sing1.08Å1.08Å
C27H27sing1.09Å1.10Å
C27H27Asing1.09Å1.10Å
C28H28sing1.09Å1.10Å
C28H28Asing1.09Å1.10Å
C29H29sing1.09Å1.10Å
C29H29Asing1.09Å1.10Å
C30H30sing1.09Å1.10Å
C30H30Asing1.09Å1.10Å
C30H30Bsing1.09Å1.10Å
C31H31sing1.09Å1.10Å
C31H31Asing1.09Å1.10Å
C32H32sing1.09Å1.10Å
C32H32Asing1.09Å1.10Å
C32H32Bsing1.09Å1.10Å
C73H73sing1.08Å1.08Å
C74H74sing1.08Å1.08Å
C75H75sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2N1C10118.0°120.8°
N1C2N2115.7°118.9°
N1C2N3124.3°122.1°
N1C10C9121.1°118.6°
N1C10H10119.5°120.7°
N2C2N3120.0°119.0°
C2N2C21124.0°120.0°
C2N2HN2118.0°120.0°
C2N3C4116.2°120.3°
N2C21C22116.6°120.0°
N2C21C26122.0°120.0°
C21N2HN2118.0°120.0°
N3C4N5118.3°121.5°
N3C4C9122.2°118.6°
N5C4C9119.5°119.9°
C4N5C5119.3°118.5°
C4N5C6122.2°123.0°
C4C9C8121.1°118.2°
C4C9C10118.2°119.6°
C5N5C6118.5°118.5°
N5C5H5109.5°109.5°
N5C5H5A109.5°109.5°
N5C5H5B109.4°109.5°
N5C6O6121.0°118.4°
N5C6N7117.5°123.2°
O6C6N7121.5°118.4°
C6N7C8121.0°119.1°
C6N7C71118.8°120.5°
C8N7C71118.4°120.5°
N7C8C9112.6°116.7°
N7C8H8108.4°108.0°
N7C8H8A108.4°108.0°
N7C71C72119.7°120.1°
N7C71C76119.9°120.1°
C8C9C10120.7°122.2°
C9C8H8108.4°108.0°
C9C8H8A108.4°108.0°
C9C10H10119.5°120.7°
C22C21C26121.4°120.0°
C21C22C23119.7°120.0°
C21C22H22120.1°120.0°
C21C26C25118.7°119.9°
C21C26H26120.7°120.0°
C22C23C24119.4°120.0°
C23C22H22120.2°120.0°
C22C23H23120.3°120.0°
C23C24O24118.0°120.0°
C23C24C25121.7°120.1°
C24C23H23120.3°120.0°
O24C24C25120.3°119.9°
C24O24C27113.1°117.0°
C24C25C26119.1°120.0°
C24C25H25120.4°120.0°
O24C27C28111.0°109.5°
O24C27H27109.0°109.4°
O24C27H27A108.9°109.5°
C26C25H25120.5°119.9°
C25C26H26120.7°120.1°
C27C28N28110.9°109.5°
C28C27H27109.0°109.5°
C28C27H27A109.0°109.5°
C27C28H28109.0°109.5°
C27C28H28A109.0°109.5°
C28N28C29111.0°111.0°
C28N28C31111.0°111.0°
N28C28H28109.0°109.5°
N28C28H28A109.0°109.5°
C29N28C31110.4°111.0°
N28C29C30110.3°109.5°
N28C29H29109.2°109.5°
N28C29H29A109.2°109.5°
N28C31C32110.7°109.5°
N28C31H31109.0°109.4°
N28C31H31A109.1°109.5°
C30C29H29109.2°109.4°
C30C29H29A109.2°109.4°
C29C30H30109.5°109.5°
C29C30H30A109.5°109.4°
C29C30H30B109.5°109.4°
C32C31H31109.1°109.5°
C32C31H31A109.0°109.5°
C31C32H32109.5°109.5°
C31C32H32A109.5°109.5°
C31C32H32B109.5°109.4°
C72C71C76120.4°119.9°
C71C72CL72120.5°120.0°
C71C72C73119.4°119.9°
C71C76C75119.8°119.9°
C71C76CL76120.4°120.1°
CL72C72C73120.1°120.0°
C72C73C74119.9°120.1°
C72C73H73120.1°120.0°
C73C74C75120.8°120.1°
C74C73H73120.1°119.9°
C73C74H74119.6°120.0°
C74C75C76119.7°120.1°
C75C74H74119.6°119.9°
C74C75H75120.1°120.0°
C75C76CL76119.9°120.0°
C76C75H75120.2°120.0°
H5C5H5A109.5°109.5°
H5C5H5B109.5°109.5°
H5AC5H5B109.5°109.4°
H8C8H8A110.5°107.8°
H27C27H27A109.9°109.5°
H28C28H28A109.9°109.5°
H29C29H29A109.8°109.5°
H30C30H30A109.5°109.5°
H30C30H30B109.5°109.5°
H30AC30H30B109.5°109.4°
H31C31H31A109.9°109.4°
H32C32H32A109.5°109.5°
H32C32H32B109.4°109.4°
H32AC32H32B109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N1C2N2N3179.9°179.8°
N1C2N2C21169.9°5.4°
N1C2N3C40.7°0.1°
C2N1C10C91.3°0.1°
N1C2N2HN210.1°174.6°
C2N1C10H10178.7°180.0°
C10N1C2N2179.8°180.0°
C10N1C2N30.1°0.1°
N1C10C9C42.0°0.0°
N1C10C9C8179.8°180.0°
N1C10C9H10180.0°179.9°
C2N2C21HN2180.0°180.0°
N2C2N3C4179.2°180.0°
C2N2C21C22176.1°146.6°
C2N2C21C264.5°33.7°
N3C2N2C2110.2°174.8°
C2N3C4N5179.8°179.9°
C2N3C4C90.1°0.0°
N3C2N2HN2169.8°5.2°
N2C21C22C26179.4°179.7°
N2C21C22C23179.7°180.0°
N2C21C26C25179.6°179.8°
N2C21C22H220.3°0.1°
N2C21C26H260.4°0.0°
N3C4N5C9179.9°179.9°
N3C4N5C58.9°0.1°
N3C4N5C6169.3°180.0°
N3C4C9C8179.6°180.0°
N3C4C9C101.4°0.0°
C4N5C5C6178.2°179.9°
C4N5C6O6178.2°179.9°
C4N5C6N71.0°0.1°
N5C4C9C80.3°0.1°
N5C4C9C10178.6°180.0°
C4N5C5H5180.0°89.9°
C4N5C5H5A60.0°150.0°
C4N5C5H5B60.0°30.1°
C9C4N5C5171.0°180.0°
C9C4N5C610.8°0.1°
C4C9C8N719.0°0.1°
C4C9C8C10178.2°179.9°
C4C9C8H8139.0°121.8°
C4C9C8H8A101.0°121.7°
C4C9C10H10178.1°179.9°
C5N5C6O60.0°0.0°
C5N5C6N7179.1°180.0°
N5C5H5H5A120.0°120.1°
N5C5H5H5B120.0°120.0°
N5C5H5AH5B120.0°119.9°
N5C6O6N7179.1°180.0°
N5C6N7C820.1°0.0°
N5C6N7C71175.4°180.0°
C6N5C5H51.8°90.0°
C6N5C5H5A118.2°30.1°
C6N5C5H5B121.8°150.0°
O6C6N7C8160.7°179.9°
O6C6N7C713.7°0.1°
C6N7C8C71164.5°180.0°
C6N7C8C929.2°0.0°
C6N7C71C7280.8°90.0°
C6N7C71C7698.8°90.3°
C6N7C8H8149.2°121.8°
C6N7C8H8A90.8°121.8°
N7C8C9H8120.0°121.8°
N7C8C9H8A120.0°121.8°
N7C8C9C10162.8°180.0°
C8N7C71C7284.1°90.0°
C8N7C71C7696.3°89.7°
N7C8H8H8A118.7°116.5°
C71N7C8C9166.2°180.0°
N7C71C72C76179.7°179.8°
N7C71C72CL722.0°0.1°
N7C71C72C73179.9°180.0°
N7C71C76C75179.8°179.7°
N7C71C76CL760.5°0.0°
C71N7C8H846.3°58.2°
C71N7C8H8A73.7°58.2°
C9C8H8H8A118.7°116.5°
C8C9C10H100.2°0.1°
C10C9C8H842.8°58.2°
C10C9C8H8A77.2°58.2°
C21C22C23H22180.0°180.0°
C21C22C23C240.3°0.0°
C22C21C26C250.2°0.5°
C22C21N2HN23.9°33.5°
C21C22C23H23179.7°179.9°
C22C21C26H26179.8°179.7°
C26C21C22C230.2°0.2°
C21C26C25C240.3°0.4°
C21C26C25H26180.0°179.8°
C26C21N2HN2175.5°146.3°
C26C21C22H22179.8°179.8°
C21C26C25H25179.7°179.8°
C22C23C24H23180.0°179.9°
C22C23C24O24179.4°180.0°
C22C23C24C250.4°0.1°
C23C24O24C25179.8°179.9°
C23C24O24C27148.0°180.0°
C23C24C25C260.3°0.2°
C24C23C22H22179.7°179.9°
C23C24C25H25179.6°180.0°
O24C24C25C26179.4°179.8°
C24O24C27C28138.5°180.0°
O24C24C23H230.6°0.1°
O24C24C25H250.6°0.0°
C24O24C27H27101.5°60.0°
C24O24C27H27A18.5°60.0°
C25C24O24C2732.2°0.0°
C24C25C26H25180.0°179.8°
C25C24C23H23179.6°180.0°
C24C25C26H26179.7°179.8°
O24C27C28H27120.0°120.0°
O24C27C28H27A120.0°120.0°
O24C27C28N2873.8°67.0°
O24C27H27H27A119.3°120.0°
O24C27C28H28166.2°173.0°
O24C27C28H28A46.2°53.0°
C27C28N28H28120.0°120.0°
C27C28N28H28A120.0°120.0°
C27C28N28C2985.4°163.4°
C27C28N28C31151.4°72.7°
C28C27H27H27A119.4°120.0°
C27C28H28H28A119.4°120.0°
C28N28C29C31123.5°124.0°
C28N28C29C30174.2°163.9°
C28N28C31C3261.6°54.2°
N28C28C27H2746.2°52.9°
N28C28C27H27A166.2°173.0°
N28C28H28H28A119.4°120.0°
C28N28C29H2965.9°44.0°
C28N28C29H29A54.2°76.1°
C28N28C31H3158.4°65.8°
C28N28C31H31A178.4°174.3°
N28C29C30H29120.0°120.0°
N28C29C30H29A120.0°120.0°
C29N28C31C32174.8°69.7°
C29N28C28H28154.6°43.4°
C29N28C28H28A34.7°76.6°
N28C29H29H29A119.7°120.1°
N28C29C30H30180.0°175.6°
N28C29C30H30A60.0°55.6°
N28C29C30H30B60.0°64.3°
C29N28C31H3165.2°170.3°
C29N28C31H31A54.8°50.4°
C31N28C29C3062.3°72.1°
N28C31C32H31120.0°120.0°
N28C31C32H31A120.0°120.1°
C31N28C28H2831.4°167.4°
C31N28C28H28A88.5°47.3°
C31N28C29H2957.7°167.9°
C31N28C29H29A177.7°47.9°
N28C31H31H31A119.5°120.0°
N28C31C32H32180.0°66.6°
N28C31C32H32A60.0°173.4°
N28C31C32H32B60.0°53.3°
C30C29H29H29A119.6°120.0°
C29C30H30H30A120.0°120.0°
C29C30H30H30B120.0°120.0°
C29C30H30AH30B120.0°119.9°
C32C31H31H31A119.5°120.0°
C31C32H32H32A120.0°120.0°
C31C32H32H32B120.0°119.9°
C31C32H32AH32B120.0°120.0°
C71C72CL72C73178.1°179.9°
C71C72C73C740.5°0.1°
C72C71C76C750.2°0.5°
C72C71C76CL76179.8°179.8°
C71C72C73H73179.6°180.0°
C76C71C72CL72177.7°179.7°
C76C71C72C730.4°0.2°
C71C76C75C740.0°0.6°
C71C76C75CL76179.7°179.7°
C71C76C75H75180.0°179.7°
CL72C72C73C74177.7°180.0°
CL72C72C73H732.3°0.1°
C72C73C74H73180.0°179.9°
C72C73C74C750.3°0.0°
C72C73C74H74179.7°179.9°
C73C74C75H74180.0°180.0°
C73C74C75C760.0°0.3°
C73C74C75H75179.9°180.0°
C74C75C76H75180.0°179.7°
C74C75C76CL76179.6°179.7°
C75C74C73H73179.7°179.9°
C76C75C74H74180.0°179.7°
CL76C76C75H750.3°0.0°
H5C5H5AH5B120.0°120.0°
H22C22C23H230.3°0.0°
H25C25C26H260.3°0.0°
H27C27C28H2873.7°67.0°
H27C27C28H28A166.3°172.9°
H27AC27C28H2846.3°53.0°
H27AC27C28H28A73.7°67.0°
H29C29C30H3060.0°64.4°
H29C29C30H30A180.0°175.5°
H29C29C30H30B60.0°55.6°
H29AC29C30H3060.0°55.6°
H29AC29C30H30A60.0°64.4°
H29AC29C30H30B180.0°175.6°
H30C30H30AH30B120.0°120.1°
H31C31C32H3260.0°53.3°
H31C31C32H32A180.0°66.7°
H31C31C32H32B60.0°173.3°
H31AC31C32H3260.0°173.3°
H31AC31C32H32A60.0°53.3°
H31AC31C32H32B180.0°66.8°
H32C32H32AH32B120.0°120.0°
H73C73C74H740.3°0.0°
H74C74C75H750.1°0.0°

224931

PDB entries from 2024-09-11

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