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BHY

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1S2sing1.66Å1.66Å
N1C15sing1.47Å1.49Å
C2C1doub1.38Å1.39ÅAromatic
C2C3sing1.38Å1.38ÅAromatic
N2S1sing1.66Å1.66Å
N2C18sing1.47Å1.48Å
C4C3doub1.39Å1.39ÅAromatic
C4C5sing1.39Å1.39ÅAromatic
C4C10sing1.48Å1.38ÅAromatic
O4S2doub1.42Å1.51Å
C6C1sing1.38Å1.39ÅAromatic
C6C5doub1.38Å1.40ÅAromatic
C7C8doub1.38Å1.38ÅAromatic
C7C12sing1.38Å1.39ÅAromatic
C7C13sing1.51Å1.50Å
C1C14sing1.51Å1.51Å
O1S1doub1.42Å1.51Å
S1O2doub1.42Å1.51Å
S1C19sing1.81Å1.76Å
S2O3doub1.42Å1.50Å
S2C20sing1.81Å1.78Å
C8C9sing1.38Å1.39ÅAromatic
C9C10doub1.39Å1.39ÅAromatic
C10C11sing1.39Å1.39ÅAromatic
C11C12doub1.38Å1.39ÅAromatic
C13C17sing1.53Å1.52Å
C13C18sing1.53Å1.53Å
C14C15sing1.53Å1.53Å
C14C16sing1.53Å1.52Å
N1HN1sing0.97Å1.00Å
C2H2sing1.08Å1.08Å
N2HN2sing0.97Å1.00Å
C6H6sing1.08Å1.08Å
C3H3sing1.08Å1.08Å
C5H5sing1.08Å1.08Å
C8H8sing1.08Å1.08Å
C9H9sing1.08Å1.08Å
C11H11sing1.08Å1.08Å
C12H12sing1.08Å1.08Å
C13H13sing1.09Å1.10Å
C14H14sing1.09Å1.10Å
C15H15sing1.09Å1.10Å
C15H15Asing1.09Å1.10Å
C16H16sing1.09Å1.10Å
C16H16Asing1.09Å1.10Å
C16H16Bsing1.09Å1.10Å
C17H17sing1.09Å1.10Å
C17H17Asing1.09Å1.10Å
C17H17Bsing1.09Å1.10Å
C18H18sing1.09Å1.10Å
C18H18Asing1.09Å1.10Å
C19H19sing1.09Å1.10Å
C19H19Asing1.09Å1.10Å
C19H19Bsing1.09Å1.10Å
C20H20sing1.09Å1.10Å
C20H20Asing1.09Å1.10Å
C20H20Bsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
S2N1C15113.8°120.0°
N1S2O4109.5°104.3°
N1S2O3108.0°104.3°
N1S2C20113.2°104.4°
S2N1HN1108.0°120.0°
N1C15C14107.2°109.5°
C15N1HN1108.0°120.0°
N1C15H15110.2°109.4°
N1C15H15A110.7°109.5°
C1C2C3120.5°120.2°
C2C1C6120.6°120.2°
C2C1C14116.5°119.9°
C1C2H2119.8°119.9°
C2C3C4119.2°119.9°
C3C2H2119.7°119.9°
C2C3H3120.4°120.1°
S1N2C18116.1°120.0°
N2S1O1109.7°104.3°
N2S1O2109.3°104.3°
N2S1C19110.3°104.5°
S1N2HN2107.3°120.0°
N2C18C13105.4°109.5°
C18N2HN2107.3°120.0°
N2C18H18110.8°109.5°
N2C18H18A111.7°109.5°
C3C4C5120.6°119.7°
C3C4C10118.4°120.1°
C4C3H3120.4°120.0°
C5C4C10120.4°120.2°
C4C5C6119.8°119.9°
C4C5H5120.1°120.0°
C4C10C9118.0°120.1°
C4C10C11120.7°120.2°
O4S2O3111.2°121.1°
O4S2C20109.2°110.5°
C1C6C5119.1°120.1°
C6C1C14122.8°119.9°
C1C6H6120.4°119.9°
C5C6H6120.5°120.0°
C6C5H5120.1°120.1°
C8C7C12120.9°120.2°
C8C7C13121.7°119.9°
C7C8C9118.5°120.1°
C7C8H8120.8°119.9°
C12C7C13117.3°119.8°
C7C12C11120.7°120.1°
C7C12H12119.7°120.0°
C7C13C17110.6°109.5°
C7C13C1898.8°109.5°
C7C13H13117.1°109.5°
C1C14C1599.0°109.5°
C1C14C16110.4°109.5°
C1C14H14116.7°109.5°
O1S1O2111.3°121.0°
O1S1C19110.5°110.6°
O2S1C19105.8°110.5°
S1C19H19109.5°109.4°
S1C19H19A109.5°109.5°
S1C19H19B109.5°109.5°
O3S2C20105.7°110.6°
S2C20H20109.5°109.5°
S2C20H20A109.5°109.4°
S2C20H20B109.4°109.4°
C8C9C10120.5°119.9°
C9C8H8120.7°120.0°
C8C9H9119.7°120.1°
C9C10C11120.8°119.7°
C10C9H9119.7°120.0°
C10C11C12118.4°119.9°
C10C11H11120.8°120.0°
C12C11H11120.8°120.0°
C11C12H12119.6°119.9°
C17C13C18113.7°109.5°
C17C13H13103.1°109.4°
C13C17H17109.5°109.5°
C13C17H17A109.5°109.5°
C13C17H17B109.5°109.5°
C18C13H13114.1°109.5°
C13C18H18110.9°109.5°
C13C18H18A111.8°109.4°
C15C14C16112.7°109.4°
C15C14H14114.5°109.5°
C14C15H15110.2°109.5°
C14C15H15A110.7°109.5°
C16C14H14103.9°109.5°
C14C16H16109.5°109.5°
C14C16H16A109.5°109.5°
C14C16H16B109.5°109.4°
H15C15H15A107.8°109.5°
H16C16H16A109.4°109.5°
H16C16H16B109.5°109.5°
H16AC16H16B109.5°109.5°
H17C17H17A109.5°109.5°
H17C17H17B109.4°109.5°
H17AC17H17B109.5°109.4°
H18C18H18A106.4°109.5°
H19C19H19A109.4°109.4°
H19C19H19B109.4°109.5°
H19AC19H19B109.5°109.5°
H20C20H20A109.5°109.5°
H20C20H20B109.4°109.5°
H20AC20H20B109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
S2N1C15HN1120.0°179.6°
N1S2O4O3119.2°116.8°
N1S2O4C20124.5°111.7°
N1S2O3C20121.4°111.7°
S2N1C15C14167.6°165.0°
S2N1C15H1547.7°75.0°
S2N1C15H15A71.5°44.9°
N1S2C20H2039.9°59.9°
N1S2C20H20A80.1°180.0°
N1S2C20H20B159.8°60.0°
C15N1S2O465.5°178.9°
N1C15C14C155.7°174.9°
C15N1S2O355.7°51.0°
C15N1S2C20172.3°65.1°
N1C15C14H15120.0°120.0°
N1C15C14H15A120.9°120.0°
N1C15C14C16172.3°65.0°
N1C15C14H1469.2°55.0°
N1C15H15H15A120.9°120.0°
C1C2C3H2180.0°179.7°
C1C2C3C41.6°0.0°
C2C1C6C14174.8°180.0°
C2C1C6C52.6°0.0°
C2C1C14C1537.5°120.0°
C2C1C14C1680.9°120.0°
C2C1C6H6177.4°180.0°
C1C2C3H3178.4°180.0°
C2C1C14H14160.7°0.0°
C2C3C4H3180.0°180.0°
C2C3C4C54.8°0.0°
C2C3C4C10176.6°180.0°
C3C2C1C62.1°0.0°
C3C2C1C14177.2°180.0°
S1N2C18HN2120.0°179.9°
N2S1O1O2121.1°116.8°
N2S1O1C19121.8°111.8°
N2S1O2C19118.7°111.8°
S1N2C18C13168.6°165.0°
S1N2C18H1848.6°75.0°
S1N2C18H18A69.8°45.0°
N2S1C19H19132.9°60.0°
N2S1C19H19A107.1°179.9°
N2S1C19H19B12.9°60.0°
N2C18C13C756.9°175.0°
C18N2S1O132.0°178.9°
C18N2S1O290.3°51.1°
C18N2S1C19153.9°65.0°
N2C18C13C17174.0°65.0°
N2C18C13H18120.0°120.0°
N2C18C13H18A121.5°120.0°
N2C18C13H1368.1°55.0°
N2C18H18H18A121.6°120.0°
C3C4C5C10171.6°180.0°
C3C4C5C64.4°0.0°
C3C4C10C911.6°180.0°
C3C4C10C11177.0°0.1°
C4C3C2H2178.4°179.7°
C3C4C5H5175.7°180.0°
C4C5C6C10.6°0.0°
C4C5C6H5180.0°180.0°
C5C4C10C9160.2°0.0°
C5C4C10C1111.2°180.0°
C4C5C6H6179.4°180.0°
C5C4C3H3175.2°180.0°
C10C4C5C6176.0°180.0°
C4C10C9C8176.4°179.9°
C4C10C9C11171.4°180.0°
C4C10C11C12176.3°179.9°
C10C4C3H33.4°0.0°
C10C4C5H54.0°0.0°
C4C10C9H93.6°0.0°
C4C10C11H113.7°0.1°
O4S2O3C20118.4°131.5°
O4S2N1HN154.5°0.7°
O4S2C20H20162.2°51.6°
O4S2C20H20A42.2°68.4°
O4S2C20H20B77.9°171.6°
C1C6C5H6180.0°180.0°
C6C1C14C15137.5°60.0°
C6C1C14C16104.1°60.0°
C6C1C2H2177.9°179.7°
C1C6C5H5179.4°180.0°
C6C1C14H1414.2°180.0°
C5C6C1C14177.3°180.0°
C8C7C12C13175.9°179.7°
C7C8C9H8180.0°180.0°
C7C8C9C101.4°0.0°
C8C7C12C111.8°0.0°
C8C7C13C17103.7°120.0°
C8C7C13C18136.9°120.0°
C7C8C9H9178.6°179.9°
C8C7C12H12178.2°180.0°
C8C7C13H1313.9°0.0°
C12C7C8C92.0°0.0°
C7C12C11C101.8°0.0°
C7C12C11H12180.0°180.0°
C12C7C13C1780.4°60.3°
C12C7C13C1839.1°59.8°
C12C7C8H8178.0°180.0°
C7C12C11H11178.2°180.0°
C12C7C13H13162.0°179.8°
C13C7C8C9177.8°179.7°
C13C7C12C11177.7°179.7°
C7C13C17C18110.0°120.1°
C7C13C17H13125.9°120.0°
C7C13C18H13125.0°120.0°
C13C7C8H82.2°0.3°
C13C7C12H122.2°0.3°
C7C13C17H1744.4°180.0°
C7C13C17H17A75.6°60.0°
C7C13C17H17B164.3°60.0°
C7C13C18H1863.0°54.9°
C7C13C18H18A178.5°65.0°
C1C14C15C16116.6°120.0°
C1C14C15H14124.9°120.0°
C1C14C16H14125.9°120.0°
C14C1C2H22.8°0.3°
C14C1C6H62.7°0.0°
C1C14C15H1564.3°55.0°
C1C14C15H15A176.5°65.0°
C1C14C16H16138.9°60.0°
C1C14C16H16A101.2°180.0°
C1C14C16H16B18.9°60.0°
O1S1O2C19120.0°131.5°
O1S1N2HN288.0°1.0°
O1S1C19H1911.5°51.6°
O1S1C19H19A131.5°68.3°
O1S1C19H19B108.5°171.6°
O2S1N2HN2149.7°128.9°
O2S1C19H19109.1°171.7°
O2S1C19H19A10.9°68.4°
O2S1C19H19B130.9°51.7°
C19S1N2HN233.9°115.1°
S1C19H19H19A120.0°120.0°
S1C19H19H19B120.0°120.0°
S1C19H19AH19B120.0°120.1°
O3S2N1HN1175.7°128.6°
O3S2C20H2078.1°171.6°
O3S2C20H20A161.9°68.4°
O3S2C20H20B41.9°51.6°
C20S2N1HN167.7°115.3°
S2C20H20H20A120.0°120.0°
S2C20H20H20B120.0°119.9°
S2C20H20AH20B120.0°119.9°
C8C9C10H9180.0°179.9°
C8C9C10C115.0°0.0°
C9C10C11C125.2°0.0°
C10C9C8H8178.6°180.0°
C9C10C11H11174.8°180.0°
C10C11C12H11180.0°180.0°
C11C10C9H9174.9°179.9°
C10C11C12H12178.2°180.0°
C17C13C18H13117.9°120.0°
C13C17H17H17A120.0°120.0°
C13C17H17H17B120.0°120.0°
C13C17H17AH17B120.0°120.0°
C17C13C18H1854.1°175.0°
C17C13C18H18A64.4°55.0°
C13C18N2HN271.4°15.0°
C18C13C17H17154.4°60.0°
C18C13C17H17A34.4°180.0°
C18C13C17H17B85.7°60.1°
C13C18H18H18A121.7°120.0°
C15C14C16H14124.5°120.0°
C14C15N1HN172.4°14.7°
C14C15H15H15A120.9°120.0°
C15C14C16H1629.3°60.0°
C15C14C16H16A149.3°60.0°
C15C14C16H16B90.7°180.0°
C16C14C15H1552.3°175.0°
C16C14C15H15A66.9°55.0°
C14C16H16H16A120.0°120.0°
C14C16H16H16B120.0°120.0°
C14C16H16AH16B120.0°120.0°
HN1N1C15H15167.7°105.3°
HN1N1C15H15A48.5°134.7°
H2C2C3H31.6°0.2°
HN2N2C18H18168.6°105.1°
HN2N2C18H18A50.2°134.9°
H6C6C5H50.6°0.0°
H8C8C9H91.4°0.0°
H11C11C12H121.8°0.0°
H13C13C17H1781.5°60.0°
H13C13C17H17A158.4°60.0°
H13C13C17H17B38.4°180.0°
H13C13C18H18172.0°65.1°
H13C13C18H18A53.5°175.0°
H14C14C15H15170.9°65.0°
H14C14C15H15A51.7°175.0°
H14C14C16H1695.3°180.0°
H14C14C16H16A24.7°60.0°
H14C14C16H16B144.7°60.0°
H16C16H16AH16B120.0°120.0°
H17C17H17AH17B119.9°120.0°
H19C19H19AH19B119.9°120.0°
H20C20H20AH20B120.0°120.0°

222415

PDB entries from 2024-07-10

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