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A1EEC

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N16C15doub1.30Å1.31ÅAromatic
N16C17sing1.36Å1.37ÅAromatic
C15N14sing1.36Å1.37ÅAromatic
C18C17doub1.40Å1.40ÅAromatic
C18N19sing1.31Å1.36ÅAromatic
C17C22sing1.41Å1.39ÅAromatic
C33C32doub1.38Å1.40ÅAromatic
C33C23sing1.39Å1.39ÅAromatic
N19C20doub1.33Å1.36ÅAromatic
N14C22sing1.37Å1.37ÅAromatic
N14C12sing1.47Å1.44Å
C13C12sing1.53Å1.54Å
C22C21doub1.39Å1.39ÅAromatic
C32C31sing1.38Å1.39ÅAromatic
C20C21sing1.39Å1.39ÅAromatic
C20C23sing1.48Å1.44Å
C12C11sing1.51Å1.52Å
C23C24doub1.39Å1.40ÅAromatic
CL01C02sing1.74Å1.73Å
C31C30doub1.38Å1.39ÅAromatic
C11C02doub1.38Å1.39ÅAromatic
C11C09sing1.38Å1.40ÅAromatic
C24C30sing1.38Å1.39ÅAromatic
C24C25sing1.51Å1.50Å
C02C03sing1.39Å1.39ÅAromatic
CL10C09sing1.74Å1.73Å
C09C08doub1.38Å1.39ÅAromatic
C25C27sing1.51Å1.53Å
C25C26sing1.53Å1.54Å
O29C27doub1.21Å1.22Å
C03C04sing1.51Å1.46Å
C03C07doub1.38Å1.39ÅAromatic
C27O28sing1.34Å1.36Å
C04C06sing1.53Å1.57Å
C04C05sing1.53Å1.56Å
C06C05sing1.53Å1.46Å
C08C07sing1.38Å1.40ÅAromatic
C15HC15sing1.08Å1.08Å
C18HC18sing1.08Å1.08Å
C21HC21sing1.08Å1.08Å
C12HC12sing1.09Å1.10Å
C13H131sing1.09Å1.10Å
C13H132sing1.09Å1.10Å
C13H133sing1.09Å1.10Å
C04HC04sing1.09Å1.10Å
C05H051sing1.09Å1.10Å
C05H052sing1.09Å1.10Å
C06H061sing1.09Å1.10Å
C06H062sing1.09Å1.10Å
C07HC07sing1.08Å1.08Å
C08HC08sing1.08Å1.08Å
C25HC25sing1.09Å1.10Å
C26H261sing1.09Å1.10Å
C26H263sing1.09Å1.10Å
C26H262sing1.09Å1.10Å
O28H1sing0.97Å0.95Å
C30HC30sing1.08Å1.08Å
C31HC31sing1.08Å1.08Å
C32HC32sing1.08Å1.08Å
C33HC33sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C15N16C17105.1°109.7°
N16C15N14111.9°110.1°
N16C15HC15124.0°125.0°
N16C17C18130.5°134.4°
N16C17C22110.9°106.8°
C15N14C22107.8°107.3°
C15N14C12125.6°126.3°
N14C15HC15124.1°124.9°
C17C18N19120.0°120.4°
C18C17C22118.7°118.8°
C17C18HC18120.0°119.8°
C18N19C20118.9°122.3°
N19C18HC18120.0°119.8°
C17C22N14104.4°106.1°
C17C22C21123.1°118.7°
C32C33C23120.0°119.9°
C33C32C31120.0°120.1°
C33C32HC32120.0°119.9°
C32C33HC33120.0°120.1°
C33C23C20119.0°120.1°
C33C23C24119.9°119.8°
C23C33HC33120.0°120.1°
N19C20C21125.6°121.0°
N19C20C23114.3°119.5°
C22N14C12126.7°126.4°
N14C22C21132.4°135.1°
N14C12C13113.0°109.4°
N14C12C11112.0°109.5°
N14C12HC12106.6°109.4°
C13C12C11113.3°109.5°
C13C12HC12105.5°109.5°
C12C13H131109.5°109.5°
C12C13H132109.5°109.5°
C12C13H133109.5°109.5°
C22C21C20113.7°118.7°
C22C21HC21123.1°120.7°
C32C31C30120.0°120.2°
C32C31HC31120.0°119.9°
C31C32HC32120.0°119.9°
C21C20C23120.1°119.5°
C20C21HC21123.1°120.6°
C20C23C24121.1°120.1°
C12C11C02120.3°120.0°
C12C11C09119.7°120.0°
C11C12HC12105.7°109.5°
C23C24C30120.0°119.8°
C23C24C25121.5°120.1°
CL01C02C11120.1°120.1°
CL01C02C03119.8°120.0°
C31C30C24120.0°120.2°
C31C30HC30120.0°119.9°
C30C31HC31120.0°119.9°
C02C11C09120.0°120.0°
C11C02C03120.1°120.0°
C11C09CL10121.6°120.0°
C11C09C08120.0°119.9°
C30C24C25118.5°120.1°
C24C30HC30120.0°119.9°
C24C25C27112.6°109.5°
C24C25C26113.8°109.4°
C24C25HC25107.5°109.5°
C02C03C04123.4°120.0°
C02C03C07120.0°120.0°
CL10C09C08118.4°120.0°
C09C08C07120.0°120.0°
C09C08HC08120.0°119.9°
C27C25C26108.5°109.5°
C25C27O29124.5°120.0°
C25C27O28112.9°120.0°
C27C25HC25107.1°109.5°
C26C25HC25107.0°109.5°
C25C26H261109.5°109.4°
C25C26H263109.5°109.5°
C25C26H262109.5°109.5°
O29C27O28122.6°120.0°
C04C03C07113.9°120.0°
C03C04C06142.5°117.5°
C03C04C05129.3°117.5°
C03C04HC04106.9°115.6°
C03C07C08120.0°120.0°
C03C07HC07120.0°120.0°
C27O28H1109.5°117.0°
C06C04C0555.6°60.0°
C04C06C0561.7°60.0°
C06C04HC04105.7°117.4°
C04C06H061119.7°117.5°
C04C06H062119.7°117.5°
C04C05C0662.7°60.0°
C05C04HC04105.9°117.5°
C04C05H051119.5°117.5°
C04C05H052119.5°117.5°
C06C05H051119.5°117.5°
C06C05H052119.6°117.5°
C05C06H061119.7°117.5°
C05C06H062119.7°117.4°
C08C07HC07120.0°120.0°
C07C08HC08120.0°120.0°
H131C13H132109.5°109.5°
H131C13H133109.5°109.5°
H132C13H133109.5°109.4°
H051C05H052109.5°115.5°
H061C06H062109.5°115.6°
H261C26H263109.5°109.4°
H261C26H262109.4°109.5°
H263C26H262109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N16C15N14HC15180.0°179.8°
C15N16C17C18179.9°179.9°
C15N16C17C220.1°0.3°
N16C15N14C220.1°0.2°
N16C15N14C12180.0°179.9°
C17N16C15N140.1°0.4°
N16C17C18C22180.0°179.8°
N16C17C18N19179.9°179.7°
N16C17C22N140.0°0.2°
N16C17C22C21180.0°179.8°
C17N16C15HC15179.9°179.9°
N16C17C18HC180.1°0.3°
C15N14C22C170.1°0.0°
C15N14C22C12179.9°179.7°
C15N14C12C136.4°64.7°
C15N14C22C21179.9°180.0°
C15N14C12C11123.0°55.3°
C15N14C12HC12121.8°175.3°
C17C18N19HC18180.0°180.0°
C17C18N19C200.1°0.0°
C18C17C22N14180.0°180.0°
C18C17C22C210.0°0.0°
N19C18C17C220.1°0.0°
C18N19C20C210.1°0.0°
C18N19C20C23179.9°180.0°
C17C22N14C21180.0°179.9°
C17C22N14C12179.9°179.7°
C17C22C21C200.0°0.0°
C22C17C18HC18179.9°180.0°
C17C22C21HC21180.0°179.9°
C32C33C23HC33180.0°179.5°
C33C32C31HC32180.0°179.8°
C32C33C23C20180.0°179.8°
C32C33C23C240.0°0.5°
C33C32C31C300.0°0.3°
C33C32C31HC31180.0°179.7°
C33C23C20N1990.0°79.7°
C23C33C32C31NaN°0.5°
C33C23C20C2190.0°100.2°
C33C23C20C24180.0°179.7°
C33C23C24C300.0°0.3°
C33C23C24C25180.0°179.7°
C23C33C32HC32180.0°179.7°
N19C20C21C220.0°0.0°
N19C20C21C23179.9°179.9°
N19C20C23C2490.0°100.6°
C20N19C18HC18179.9°180.0°
N19C20C21HC21179.9°179.9°
C22N14C12C13173.8°115.7°
N14C22C21C20180.0°180.0°
C22N14C12C1156.8°124.3°
C22N14C15HC15179.9°180.0°
N14C22C21HC210.0°0.0°
C22N14C12HC1258.3°4.3°
N14C12C13C11128.8°120.0°
N14C12C13HC12116.1°119.9°
C12N14C22C210.0°0.4°
N14C12C11HC12115.7°120.0°
N14C12C11C02116.9°102.5°
N14C12C11C0963.0°77.3°
C12N14C15HC150.0°0.3°
N14C12C13H131180.0°14.1°
N14C12C13H13260.0°106.0°
N14C12C13H13360.0°134.1°
C13C12C11HC12115.0°120.1°
C13C12C11C02113.8°137.5°
C13C12C11C0966.3°42.7°
C12C13H131H132120.0°120.0°
C12C13H131H133120.0°120.0°
C12C13H132H133120.0°119.9°
C22C21C20HC21180.0°180.0°
C22C21C20C23179.9°180.0°
C32C31C30HC31180.0°180.0°
C32C31C30C240.0°0.0°
C32C31C30HC30180.0°179.9°
C31C32C33HC33180.0°180.0°
C21C20C23C2490.1°79.4°
C20C23C24C30180.0°179.9°
C20C23C24C250.1°0.1°
C23C20C21HC210.1°0.0°
C20C23C33HC330.0°0.3°
C12C11C02CL010.1°0.1°
C12C11C02C09179.9°179.8°
C12C11C02C03179.9°180.0°
C12C11C09CL100.1°0.0°
C12C11C09C08179.9°179.8°
C11C12C13H13151.2°105.9°
C11C12C13H13268.8°134.0°
C11C12C13H133171.2°14.1°
C23C24C30C310.0°0.0°
C23C24C30C25180.0°180.0°
C23C24C25C27117.3°112.7°
C23C24C25C26118.7°127.3°
C23C24C25HC250.4°7.4°
C23C24C30HC30180.0°179.9°
C24C23C33HC33180.0°180.0°
CL01C02C11C03179.9°179.9°
CL01C02C11C09179.9°179.7°
CL01C02C03C0419.9°0.0°
CL01C02C03C07179.9°180.0°
C31C30C24HC30180.0°179.9°
C31C30C24C25180.0°180.0°
C30C31C32HC32180.0°180.0°
C02C11C09CL10180.0°179.8°
C02C11C09C080.0°0.4°
C11C02C03C04160.1°179.9°
C11C02C03C070.0°0.0°
C02C11C12HC121.3°17.5°
C09C11C02C030.0°0.2°
C11C09CL10C08180.0°179.8°
C11C09C08C070.0°0.4°
C09C11C12HC12178.6°162.7°
C11C09C08HC08180.0°179.7°
C30C24C25C2762.8°67.3°
C30C24C25C2661.2°52.7°
C30C24C25HC25179.6°172.6°
C24C30C31HC31180.0°180.0°
C24C25C27C26126.8°120.0°
C24C25C27HC25117.9°120.0°
C24C25C26HC25118.6°120.0°
C24C25C27O291.4°0.0°
C24C25C27O28179.1°180.0°
C24C25C26H261180.0°180.0°
C24C25C26H26360.0°60.0°
C24C25C26H26260.0°60.0°
C25C24C30HC300.0°0.1°
C02C03C04C07161.1°180.0°
C02C03C04C0658.9°120.0°
C02C03C04C05141.3°171.4°
C02C03C07C080.0°0.0°
C02C03C04HC0490.5°25.6°
C02C03C07HC07180.0°180.0°
CL10C09C08C07180.0°179.8°
CL10C09C08HC080.0°0.1°
C09C08C07C030.0°0.2°
C09C08C07HC08180.0°179.9°
C09C08C07HC07180.0°179.8°
C27C25C26HC25115.2°120.0°
C25C27O29O28179.5°180.0°
C27C25C26H26153.8°60.0°
C27C25C26H263173.8°180.0°
C27C25C26H26266.2°60.0°
C25C27O28H1179.6°179.9°
C26C25C27O29125.5°120.0°
C26C25C27O2854.1°60.0°
C25C26H261H263120.0°120.0°
C25C26H261H262120.0°120.0°
C25C26H263H262120.0°120.1°
O29C27C25HC25119.3°120.0°
O29C27O28H10.0°0.0°
C03C04C06C05111.7°107.5°
C03C04C06HC04149.6°144.9°
C03C04C05HC04128.6°145.1°
C04C03C07C08161.9°179.9°
C03C04C05H051116.8°145.0°
C03C04C05H05222.8°0.1°
C03C04C06H0611.7°0.0°
C03C04C06H062138.4°145.0°
C04C03C07HC0718.1°0.1°
C07C03C04C06102.2°60.1°
C07C03C04C0519.8°8.6°
C03C07C08HC07180.0°180.0°
C07C03C04HC04108.4°154.4°
C03C07C08HC08180.0°179.9°
O28C27C25HC2561.1°60.0°
C06C04C05HC0498.4°107.4°
C04C06C05H061109.9°107.5°
C04C06C05H062109.9°107.5°
C06C04C05H051110.2°107.5°
C06C04C05H052110.2°107.5°
C04C06H061H062143.8°145.7°
C04C05H051H052143.3°145.7°
C06C05H051H052143.3°145.6°
C05C06H061H062143.8°145.7°
HC12C12C13H13163.9°134.0°
HC12C12C13H132176.1°14.0°
HC12C12C13H13356.1°105.9°
H131C13H132H133120.0°120.0°
HC04C04C05H05111.8°0.1°
HC04C04C05H052151.4°145.1°
HC04C04C06H061151.3°144.9°
HC04C04C06H06211.2°0.1°
H051C05C06H061139.9°145.0°
H051C05C06H0620.2°0.1°
H052C05C06H0610.2°0.0°
H052C05C06H062139.9°145.0°
HC07C07C08HC080.0°0.0°
HC25C25C26H26161.4°60.0°
HC25C25C26H26358.6°59.9°
HC25C25C26H262178.6°180.0°
H261C26H263H262120.0°120.0°
HC30C30C31HC310.0°0.1°
HC31C31C32HC320.0°0.0°
HC32C32C33HC330.0°0.2°

247947

PDB entries from 2026-01-21

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