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A1AUV

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.53Å1.53Å
C1C6sing1.53Å1.54Å
C2C3sing1.53Å1.53Å
C3C4sing1.53Å1.54Å
C6C5sing1.53Å1.53Å
C5C4sing1.53Å1.53Å
C5C7sing1.51Å1.55Å
C7C8doub1.38Å1.40ÅAromatic
C7C12sing1.38Å1.40ÅAromatic
C8C9sing1.38Å1.40ÅAromatic
C12C11doub1.38Å1.40ÅAromatic
C9C10doub1.38Å1.40ÅAromatic
C11C10sing1.38Å1.40ÅAromatic
C10S1sing1.76Å1.85Å
O3S1doub1.42Å1.66Å
S1O2doub1.42Å1.66Å
S1N1sing1.66Å1.73Å
O1C14sing1.35Å1.40Å
C14N2sing1.36Å1.37ÅAromatic
C14C13doub1.38Å1.40ÅAromatic
N1C13sing1.41Å1.48Å
N4N2sing1.40Å1.38ÅAromatic
N4C16doub1.31Å1.32ÅAromatic
C19C17sing1.53Å1.39Å
C19C18sing1.53Å1.39Å
N2C15sing1.37Å1.30ÅAromatic
C13C20sing1.40Å1.41ÅAromatic
C17C16sing1.51Å1.53Å
C17C18sing1.53Å1.39Å
C16N3sing1.33Å1.36ÅAromatic
C15N3doub1.33Å1.40ÅAromatic
C15N5sing1.34Å1.37ÅAromatic
C20N5doub1.32Å1.34ÅAromatic
C20C21sing1.51Å1.54Å
N1H1sing0.97Å1.00Å
C4H2sing1.09Å1.10Å
C4H3sing1.09Å1.10Å
C5H4sing1.09Å1.10Å
C6H5sing1.09Å1.10Å
C6H6sing1.09Å1.10Å
C8H7sing1.08Å1.08Å
C17H9sing1.09Å1.10Å
C21H10sing1.09Å1.10Å
C21H11sing1.09Å1.10Å
C21H12sing1.09Å1.10Å
C1H13sing1.09Å1.10Å
C1H14sing1.09Å1.10Å
C11H15sing1.08Å1.08Å
C12H16sing1.08Å1.08Å
C18H17sing1.09Å1.10Å
C18H18sing1.09Å1.10Å
C19H19sing1.09Å1.10Å
C19H20sing1.09Å1.10Å
C2H21sing1.09Å1.10Å
C2H22sing1.09Å1.10Å
C3H23sing1.09Å1.10Å
C3H24sing1.09Å1.10Å
C9H25sing1.08Å1.08Å
O1H8sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C6111.9°109.5°
C1C2C3111.6°109.5°
C2C1H13108.9°109.5°
C2C1H14108.9°109.5°
C1C2H21109.0°109.5°
C1C2H22108.9°109.5°
C1C6C5112.2°109.5°
C1C6H5108.8°109.5°
C1C6H6108.8°109.5°
C6C1H13108.9°109.4°
C6C1H14108.9°109.5°
C2C3C4111.9°109.5°
C3C2H21109.0°109.5°
C3C2H22108.9°109.5°
C2C3H23108.8°109.5°
C2C3H24108.8°109.5°
C3C4C5112.1°109.5°
C3C4H2108.8°109.5°
C3C4H3108.8°109.5°
C4C3H23108.9°109.4°
C4C3H24108.9°109.5°
C6C5C4111.6°109.5°
C6C5C7109.3°109.5°
C6C5H4109.1°109.5°
C5C6H5108.8°109.5°
C5C6H6108.8°109.5°
C4C5C7108.7°109.5°
C5C4H2108.8°109.5°
C5C4H3108.8°109.5°
C4C5H4109.2°109.5°
C5C7C8120.3°120.0°
C5C7C12119.9°120.0°
C7C5H4108.9°109.5°
C8C7C12119.8°120.0°
C7C8C9120.1°120.0°
C7C8H7119.9°120.0°
C7C12C11120.1°120.0°
C7C12H16120.0°120.0°
C8C9C10120.0°120.0°
C9C8H7120.0°120.0°
C8C9H25120.0°120.0°
C12C11C10120.1°120.0°
C12C11H15119.9°120.0°
C11C12H16119.9°119.9°
C9C10C11119.9°120.0°
C9C10S1120.0°120.0°
C10C9H25120.0°120.0°
C11C10S1120.1°120.0°
C10C11H15120.0°120.0°
C10S1O3109.3°106.5°
C10S1O2109.6°106.4°
C10S1N1109.8°107.2°
O3S1O2109.4°123.1°
O3S1N1109.4°106.4°
O2S1N1109.4°106.4°
S1N1C13120.1°119.9°
S1N1H1106.8°120.0°
O1C14N2120.0°120.6°
O1C14C13120.4°120.7°
C14O1H8109.5°114.0°
N2C14C13119.6°118.7°
C14N2N4130.4°133.3°
C14N2C15121.3°120.3°
C14C13N1121.1°120.6°
C14C13C20117.6°118.9°
N1C13C20121.3°120.5°
C13N1H1106.7°120.0°
N2N4C16109.1°107.0°
N4N2C15108.3°106.5°
N4C16C17125.5°125.2°
N4C16N3107.6°109.7°
C17C19C1860.0°60.0°
C19C17C16149.9°117.5°
C19C17C1860.0°60.0°
C19C17H990.2°117.5°
C17C19H19120.0°117.5°
C17C19H20120.0°117.5°
C19C18C1760.0°60.0°
C19C18H17120.0°117.5°
C19C18H18120.0°117.5°
C18C19H19120.0°117.5°
C18C19H20120.0°117.5°
N2C15N3108.0°107.1°
N2C15N5120.7°120.5°
C13C20N5119.1°120.3°
C13C20C21120.5°119.8°
C16C17C18150.1°117.5°
C17C16N3126.9°125.1°
C16C17H990.2°115.5°
C18C17H990.2°117.5°
C17C18H17120.0°117.5°
C17C18H18120.0°117.5°
C16N3C15107.0°109.7°
N3C15N5131.3°132.3°
C15N5C20121.6°121.2°
N5C20C21120.4°119.9°
C20C21H10109.5°109.5°
C20C21H11109.5°109.5°
C20C21H12109.4°109.5°
H2C4H3109.5°109.4°
H5C6H6109.5°109.4°
H10C21H11109.5°109.4°
H10C21H12109.5°109.4°
H11C21H12109.5°109.5°
H13C1H14109.4°109.5°
H17C18H18109.4°115.6°
H19C19H20109.5°115.5°
H21C2H22109.5°109.4°
H23C3H24109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C6H13120.4°120.0°
C2C1C6H14120.4°120.0°
C1C2C3H21120.3°120.0°
C1C2C3H22120.3°120.1°
C1C2C3C453.8°60.0°
C2C1C6C553.7°60.0°
C2C1C6H5174.1°60.0°
C2C1C6H666.7°180.0°
C2C1H13H14118.9°120.1°
C1C2H21H22119.0°120.0°
C1C2C3H23174.2°60.0°
C1C2C3H2466.6°180.0°
C6C1C2C353.8°60.0°
C1C6C5H5120.4°120.0°
C1C6C5H6120.4°120.0°
C1C6C5C453.2°60.0°
C1C6C5C7173.5°180.0°
C1C6C5H467.5°60.0°
C1C6H5H6118.8°120.0°
C6C1H13H14118.9°119.9°
C6C1C2H2166.5°60.0°
C6C1C2H22174.1°179.9°
C2C3C4H23120.4°120.0°
C2C3C4H24120.4°120.1°
C2C3C4C553.7°60.0°
C2C3C4H266.6°180.0°
C2C3C4H3174.1°60.1°
C3C2C1H1366.6°179.9°
C3C2C1H14174.2°60.0°
C3C2H21H22119.0°120.0°
C2C3H23H24118.8°120.1°
C3C4C5C653.2°60.0°
C3C4C5H2120.4°120.0°
C3C4C5H3120.4°120.0°
C3C4C5C7173.8°180.0°
C3C4H2H3118.8°120.0°
C3C4C5H467.5°60.0°
C4C3C2H2166.5°60.0°
C4C3C2H22174.1°180.0°
C4C3H23H24118.9°120.0°
C6C5C4C7120.6°120.0°
C6C5C4H4120.7°120.0°
C6C5C7H4119.1°120.0°
C6C5C7C84.8°120.0°
C6C5C7C12175.3°59.8°
C6C5C4H267.2°180.0°
C6C5C4H3173.6°60.0°
C5C6H5H6118.8°120.0°
C5C6C1H1366.7°180.0°
C5C6C1H14174.1°60.1°
C4C5C7H4118.8°120.0°
C4C5C7C8117.3°120.0°
C4C5C7C1262.7°60.2°
C5C4H2H3118.8°120.0°
C4C5C6H5173.6°60.0°
C4C5C6H667.2°180.0°
C5C4C3H23174.1°60.0°
C5C4C3H2466.6°179.9°
C5C7C8C12179.9°179.8°
C5C7C8C9180.0°180.0°
C5C7C12C11179.9°180.0°
C7C5C4H253.4°60.0°
C7C5C4H365.8°60.0°
C7C5C6H566.1°60.0°
C7C5C6H653.1°60.0°
C5C7C8H70.1°0.0°
C5C7C12H160.1°0.1°
C7C8C9H7180.0°180.0°
C8C7C12C110.0°0.2°
C7C8C9C100.1°0.1°
C8C7C5H4123.9°0.0°
C8C7C12H16179.9°179.8°
C7C8C9H25180.0°180.0°
C12C7C8C90.0°0.1°
C7C12C11H16180.0°179.9°
C7C12C11C100.0°0.0°
C12C7C5H456.2°179.9°
C12C7C8H7180.0°179.8°
C7C12C11H15180.0°180.0°
C8C9C10H25180.0°179.9°
C8C9C10C110.1°0.3°
C8C9C10S1180.0°180.0°
C12C11C10C90.0°0.3°
C12C11C10H15180.0°180.0°
C12C11C10S1180.0°180.0°
C9C10C11S1180.0°179.7°
C9C10S1O3130.7°14.1°
C9C10S1O210.9°118.9°
C9C10S1N1109.3°127.6°
C10C9C8H7180.0°179.9°
C9C10C11H15180.0°179.7°
C11C10S1O349.3°166.2°
C11C10S1O2169.1°60.9°
C11C10S1N170.8°52.6°
C10C11C12H16179.9°180.0°
C11C10C9H25180.0°179.8°
C10S1O3O2119.9°123.0°
C10S1O3N1120.3°114.1°
C10S1O2N1120.4°114.1°
C10S1N1C1386.0°63.4°
C10S1N1H135.5°116.2°
S1C10C11H150.0°0.0°
S1C10C9H250.0°0.1°
O3S1O2N1119.8°122.9°
O3S1N1C13154.0°50.2°
O3S1N1H184.5°130.1°
O2S1N1C1334.2°176.9°
O2S1N1H1155.7°2.7°
S1N1C13C1473.8°8.7°
S1N1C13H1121.5°179.7°
S1N1C13C20106.2°171.3°
O1C14N2C13179.9°180.0°
O1C14C13N10.1°0.0°
O1C14N2N40.1°0.0°
O1C14N2C15180.0°180.0°
O1C14C13C20179.9°180.0°
N2C14C13N1180.0°179.9°
C14N2N4C15180.0°180.0°
C14N2N4C16180.0°179.9°
N2C14C13C200.0°0.0°
C14N2C15N3180.0°180.0°
C14N2C15N50.1°0.0°
N2C14O1H8180.0°25.1°
C14C13N1C20180.0°180.0°
C13C14N2N4180.0°180.0°
C13C14N2C150.0°0.0°
C14C13C20N50.0°0.0°
C14C13C20C21180.0°180.0°
C14C13N1H147.7°171.6°
C13C14O1H80.1°154.9°
N1C13C20N5180.0°180.0°
N1C13C20C210.0°0.0°
N2N4C16C17179.9°180.0°
N2N4C16N30.0°0.0°
N4N2C15N30.0°0.0°
N4N2C15N5179.9°180.0°
N4C16C17C1982.1°171.4°
C16N4N2C150.0°0.0°
N4C16C17N3179.9°179.9°
N4C16C17C1896.7°120.0°
N4C16N3C150.0°0.0°
N4C16C17H9172.7°25.7°
C17C19C18H19109.5°107.5°
C17C19C18H20109.5°107.5°
C19C17C16C18178.8°68.6°
C19C17C16H990.6°145.7°
C19C17C18H990.1°107.5°
C19C17C16N397.8°8.7°
C17C19C18H17109.5°107.5°
C17C19C18H18109.5°107.4°
C17C19H19H20144.7°145.7°
C19C18H17H18144.7°145.8°
C18C19H19H20144.7°145.6°
N2C15N3C160.0°0.0°
N2C15N3N5179.9°180.0°
N2C15N5C200.1°0.0°
C13C20N5C150.0°0.0°
C13C20N5C21180.0°179.9°
C20C13N1H1132.3°8.4°
C13C20C21H10180.0°90.0°
C13C20C21H1160.0°150.0°
C13C20C21H1260.0°30.0°
C16C17C18H990.6°145.0°
C17C16N3C15179.9°180.0°
C16C17C18H1771.2°0.0°
C16C17C18H1869.8°145.0°
C16C17C19H1971.2°145.0°
C16C17C19H2069.8°0.0°
C18C17C16N383.5°60.0°
C17C18H17H18144.7°145.6°
C16N3C15N5179.9°179.9°
N3C16C17H97.1°154.4°
N3C15N5C20180.0°180.0°
C15N5C20C21180.0°179.9°
N5C20C21H100.0°90.0°
N5C20C21H11120.0°30.0°
N5C20C21H12120.0°150.0°
C20C21H10H11120.0°120.0°
C20C21H10H12120.0°120.0°
C20C21H11H12120.0°120.0°
H2C4C5H4172.1°60.0°
H2C4C3H2353.7°60.0°
H2C4C3H24173.0°60.0°
H3C4C5H452.9°180.0°
H3C4C3H2365.5°179.9°
H3C4C3H2453.8°60.0°
H4C5C6H552.9°180.0°
H4C5C6H6172.1°60.0°
H5C6C1H1353.7°60.0°
H5C6C1H1465.5°179.9°
H6C6C1H13172.9°60.0°
H6C6C1H1453.7°59.9°
H7C8C9H250.0°0.1°
H9C17C18H1719.4°145.0°
H9C17C18H18160.4°0.0°
H9C17C19H1919.4°0.0°
H9C17C19H20160.5°145.0°
H10C21H11H12120.0°119.9°
H13C1C2H21173.1°59.9°
H13C1C2H2253.7°60.0°
H14C1C2H2153.8°180.0°
H14C1C2H2265.5°60.1°
H15C11C12H160.1°0.0°
H17C18C19H190.0°145.0°
H17C18C19H20141.1°0.1°
H18C18C19H19141.0°0.1°
H18C18C19H200.0°145.0°
H21C2C3H2353.9°180.0°
H21C2C3H24173.1°60.0°
H22C2C3H2365.5°60.1°
H22C2C3H2453.7°59.9°

248335

PDB entries from 2026-01-28

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