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DEY

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O32S36doub1.42Å1.45Å
S36O31doub1.42Å1.44Å
S36C9sing1.77Å1.77Å
S36N26sing1.67Å1.67Å
C9C5doub1.37Å1.40ÅAromatic
C9C7sing1.40Å1.41ÅAromatic
C5C8sing1.39Å1.40ÅAromatic
C8O34sing1.36Å1.37Å
C8C3doub1.39Å1.40ÅAromatic
O34C22sing1.43Å1.43Å
C22C17sing1.53Å1.53Å
C22C16sing1.51Å1.53Å
C16O30doub1.21Å1.22Å
C16N28sing1.35Å1.37Å
C3C2sing1.38Å1.39ÅAromatic
N26C14sing1.39Å1.41Å
C14N24doub1.30Å1.30Å
C14C12sing1.47Å1.45Å
N24C7sing1.36Å1.40Å
C7C2doub1.40Å1.41ÅAromatic
C12C13doub1.39Å1.34Å
C12C15sing1.42Å1.48Å
C13O33sing1.35Å1.37Å
C13C11sing1.42Å1.48Å
C15O29doub1.22Å1.23Å
C15N27sing1.35Å1.38Å
N27C21sing1.46Å1.45Å
N27N25sing1.40Å1.39Å
C21C20sing1.53Å1.54Å
C20C23sing1.53Å1.55Å
C23C19sing1.53Å1.52Å
C23C18sing1.53Å1.53Å
N25C11doub1.31Å1.30Å
C11C10sing1.48Å1.47Å
C10C4doub1.35Å1.37ÅAromatic
C10S35sing1.76Å1.71ÅAromatic
C4C1sing1.38Å1.39ÅAromatic
S35C6sing1.76Å1.71ÅAromatic
C6C1doub1.34Å1.37ÅAromatic
C5H5sing1.08Å1.08Å
C22H22sing1.09Å1.10Å
C17H17sing1.09Å1.10Å
C17H17Asing1.09Å1.10Å
C17H17Bsing1.09Å1.10Å
N28HN28sing0.97Å1.00Å
N28HN2Asing0.97Å1.00Å
C3H3sing1.08Å1.08Å
N26HN26sing0.97Å1.00Å
C2H2sing1.08Å1.08Å
O33HO33sing0.97Å0.95Å
C21H21sing1.09Å1.10Å
C21H21Asing1.09Å1.10Å
C20H20sing1.09Å1.10Å
C20H20Asing1.09Å1.10Å
C23H23sing1.09Å1.10Å
C19H19sing1.09Å1.10Å
C19H19Asing1.09Å1.10Å
C19H19Bsing1.09Å1.10Å
C18H18sing1.09Å1.10Å
C18H18Asing1.09Å1.10Å
C18H18Bsing1.09Å1.10Å
C4H4sing1.08Å1.08Å
C6H6sing1.08Å1.08Å
C1H1sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O32S36O31118.9°123.7°
O32S36C9106.0°107.0°
O32S36N26107.3°107.0°
O31S36C9112.4°107.0°
O31S36N26109.1°107.0°
C9S36N26101.6°103.5°
S36C9C5118.9°121.3°
S36C9C7120.3°117.5°
S36N26C14123.2°116.4°
S36N26HN26118.4°121.8°
C5C9C7120.6°121.2°
C9C5C8119.4°119.7°
C9C5H5120.3°120.2°
C9C7N24125.0°120.9°
C9C7C2119.2°118.7°
C5C8O34121.8°120.1°
C5C8C3120.5°119.8°
C8C5H5120.3°120.1°
O34C8C3117.7°120.1°
C8O34C22120.4°117.0°
C8C3C2119.9°120.6°
C8C3H3120.0°119.6°
O34C22C17109.3°109.5°
O34C22C16109.3°109.5°
O34C22H22110.7°109.5°
C17C22C16112.3°109.5°
C17C22H22107.6°109.4°
C22C17H17109.5°109.5°
C22C17H17A109.4°109.4°
C22C17H17B109.5°109.5°
C22C16O30123.7°120.0°
C22C16N28114.6°120.0°
C16C22H22107.6°109.4°
O30C16N28121.6°120.0°
C16N28HN28110.4°120.1°
C16N28HN2A124.8°120.0°
C3C2C7120.3°120.0°
C2C3H3120.1°119.8°
C3C2H2119.8°120.0°
N26C14N24127.1°123.2°
N26C14C12114.1°118.4°
C14N26HN26118.4°121.8°
N24C14C12118.9°118.4°
C14N24C7119.9°127.5°
C14C12C13121.6°120.6°
C14C12C15118.2°120.6°
N24C7C2115.7°120.4°
C7C2H2119.9°120.1°
C13C12C15120.2°118.8°
C12C13O33123.0°120.4°
C12C13C11117.4°119.2°
C12C15O29119.1°120.2°
C12C15N27116.0°119.6°
O33C13C11119.4°120.5°
C13O33HO33109.5°113.9°
C13C11N25123.2°120.4°
C13C11C10113.8°119.8°
O29C15N27124.7°120.2°
C15N27C21116.7°119.6°
C15N27N25124.1°120.8°
C21N27N25119.2°119.6°
N27C21C20108.7°109.5°
N27C21H21109.8°109.4°
N27C21H21A109.9°109.5°
N27N25C11118.1°121.2°
C21C20C23115.2°109.5°
C20C21H21109.7°109.5°
C20C21H21A109.9°109.5°
C21C20H20107.6°109.5°
C21C20H20A106.3°109.5°
C20C23C19114.6°109.5°
C20C23C18112.4°109.5°
C23C20H20107.6°109.5°
C23C20H20A106.3°109.4°
C20C23H23102.9°109.5°
C19C23C18107.1°109.4°
C19C23H23108.7°109.5°
C23C19H19109.5°109.4°
C23C19H19A109.5°109.5°
C23C19H19B109.5°109.5°
C18C23H23111.1°109.5°
C23C18H18109.5°109.4°
C23C18H18A109.5°109.4°
C23C18H18B109.5°109.5°
N25C11C10122.9°119.8°
C11C10C4129.0°125.3°
C11C10S35119.3°125.2°
C4C10S35111.7°109.5°
C10C4C1111.2°114.7°
C10C4H4124.4°122.7°
C10S35C692.6°91.0°
C4C1C6115.1°115.1°
C1C4H4124.4°122.6°
C4C1H1122.4°122.5°
S35C6C1109.4°109.7°
S35C6H6125.3°125.1°
C1C6H6125.3°125.1°
C6C1H1122.5°122.4°
H17C17H17A109.5°109.4°
H17C17H17B109.5°109.5°
H17AC17H17B109.5°109.4°
HN28N28HN2A124.8°119.9°
H21C21H21A108.8°109.5°
H20C20H20A114.0°109.4°
H19C19H19A109.4°109.5°
H19C19H19B109.4°109.4°
H19AC19H19B109.5°109.5°
H18C18H18A109.4°109.5°
H18C18H18B109.5°109.5°
H18AC18H18B109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O32S36O31C9124.7°124.8°
O32S36O31N26123.5°124.8°
O32S36C9N26112.0°112.8°
O32S36C9C577.3°44.6°
O32S36C9C798.2°135.4°
O32S36N26C1499.8°148.9°
O32S36N26HN2680.2°31.2°
O31S36C9N26116.4°112.8°
O31S36C9C554.3°89.8°
O31S36C9C7130.2°90.2°
O31S36N26C14130.1°76.7°
O31S36N26HN2649.9°103.2°
S36C9C5C7175.5°180.0°
S36C9C5C8177.3°179.7°
C9S36N26C1411.2°36.1°
S36C9C7N244.3°0.8°
S36C9C7C2177.7°179.6°
S36C9C5H52.7°0.3°
C9S36N26HN26168.8°144.0°
N26S36C9C5170.7°157.4°
N26S36C9C713.8°22.6°
S36N26C14HN26180.0°179.9°
S36N26C14N242.3°30.4°
S36N26C14C12179.0°149.6°
C9C5C8H5180.0°180.0°
C9C5C8O34178.5°180.0°
C9C5C8C30.5°0.1°
C5C9C7N24179.8°179.3°
C5C9C7C22.3°0.4°
C7C9C5C81.8°0.2°
C9C7C2C31.4°0.3°
C9C7N24C1411.7°13.3°
C9C7N24C2178.0°179.7°
C7C9C5H5178.2°179.7°
C9C7C2H2178.6°179.7°
C5C8O34C3179.0°179.9°
C5C8O34C2210.7°1.0°
C5C8C3C20.3°0.2°
C5C8C3H3179.7°179.9°
C8O34C22C1778.0°86.1°
C8O34C22C16158.8°153.9°
O34C8C3C2179.4°179.9°
O34C8C5H51.5°0.0°
C8O34C22H2240.4°33.9°
O34C8C3H30.7°0.0°
C3C8O34C22170.3°178.9°
C8C3C2H3180.0°179.9°
C8C3C2C70.1°0.0°
C3C8C5H5179.5°179.9°
C8C3C2H2179.9°180.0°
O34C22C17C16121.4°120.1°
O34C22C17H22120.3°120.0°
O34C22C16H22120.3°120.0°
O34C22C16O30177.2°5.0°
O34C22C16N281.2°175.0°
O34C22C17H1772.3°180.0°
O34C22C17H17A167.7°60.0°
O34C22C17H17B47.7°59.9°
C17C22C16H22118.3°119.9°
C17C22C16O3061.4°115.1°
C17C22C16N28120.2°65.0°
C22C17H17H17A120.0°119.9°
C22C17H17H17B120.0°120.1°
C22C17H17AH17B120.0°120.0°
C22C16O30N28178.3°180.0°
C16C22C17H17166.3°59.9°
C16C22C17H17A46.3°60.0°
C16C22C17H17B73.7°180.0°
C22C16N28HN280.6°0.0°
C22C16N28HN2A179.3°180.0°
O30C16C22H2256.9°125.0°
O30C16N28HN28179.1°180.0°
O30C16N28HN2A0.9°0.0°
N28C16C22H22121.5°55.0°
C16N28HN28HN2A180.0°180.0°
C3C2C7N24179.6°179.4°
C3C2C7H2180.0°180.0°
N26C14N24C12178.7°180.0°
N26C14N24C715.7°2.6°
N26C14C12C130.3°180.0°
N26C14C12C15179.6°0.3°
C14N24C7C2166.3°166.3°
N24C14C12C13178.5°0.1°
N24C14C12C150.8°179.7°
N24C14N26HN26177.7°149.7°
C12C14N24C7165.7°177.5°
C14C12C13C15179.2°179.6°
C14C12C13O3317.9°0.1°
C14C12C13C11168.3°180.0°
C14C12C15O294.3°0.1°
C14C12C15N27171.1°180.0°
C12C14N26HN261.0°30.3°
N24C7C2H20.4°0.6°
C7C2C3H3179.9°179.9°
C12C13O33C11173.6°179.9°
C13C12C15O29174.9°179.7°
C13C12C15N279.7°0.3°
C12C13C11N258.4°0.1°
C12C13C11C10172.5°180.0°
C12C13O33HO33160.5°174.5°
C15C12C13O33161.3°179.7°
C15C12C13C1112.4°0.4°
C12C15O29N27175.0°179.9°
C12C15N27C21176.8°180.0°
C12C15N27N252.0°0.0°
O33C13C11N25165.6°180.0°
O33C13C11C1013.5°0.1°
C13C11N25N270.9°0.2°
C13C11N25C10179.0°179.9°
C13C11C10C429.6°139.4°
C13C11C10S35146.5°40.9°
C11C13O33HO3313.2°5.6°
O29C15N27C211.7°0.1°
O29C15N27N25177.2°179.9°
C15N27C21N25178.9°180.0°
C15N27C21C2079.7°90.0°
C15N27N25C112.1°0.3°
C15N27C21H2140.3°150.0°
C15N27C21H21A160.0°30.0°
N27C21C20H21120.0°119.9°
N27C21C20H21A120.3°120.0°
N27C21C20C2352.3°180.0°
C21N27N25C11179.1°179.7°
N27C21H21H21A120.3°120.0°
N27C21C20H2067.7°60.0°
N27C21C20H20A169.8°60.0°
N25N27C21C20101.4°90.0°
N27N25C11C10180.0°179.7°
N25N27C21H21138.6°30.0°
N25N27C21H21A18.9°150.0°
C21C20C23H20120.0°120.0°
C21C20C23H20A117.4°120.0°
C21C20C23C19178.9°65.0°
C21C20C23C1856.3°175.0°
C20C21H21H21A120.3°120.0°
C21C20H20H20A117.6°120.0°
C21C20C23H2363.3°55.0°
C20C23C19C18125.4°120.0°
C20C23C19H23114.5°120.0°
C20C23C18H23114.7°120.0°
C23C20C21H21172.4°60.0°
C23C20C21H21A68.0°60.0°
C23C20H20H20A117.7°119.9°
C20C23C19H19126.4°60.0°
C20C23C19H19A113.6°60.0°
C20C23C19H19B6.4°179.9°
C20C23C18H1868.1°60.0°
C20C23C18H18A171.9°180.0°
C20C23C18H18B51.9°60.0°
C19C23C18H23118.5°120.0°
C19C23C20H2061.1°55.1°
C19C23C20H20A61.4°175.0°
C23C19H19H19A120.0°120.0°
C23C19H19H19B120.0°120.0°
C23C19H19AH19B120.0°120.1°
C19C23C18H18165.2°180.0°
C19C23C18H18A45.2°60.0°
C19C23C18H18B74.8°60.0°
C18C23C20H20176.3°64.9°
C18C23C20H20A61.2°55.0°
C18C23C19H191.0°180.0°
C18C23C19H19A120.9°60.0°
C18C23C19H19B119.0°60.1°
C23C18H18H18A120.0°119.9°
C23C18H18H18B120.0°120.0°
C23C18H18AH18B120.0°120.0°
N25C11C10C4149.5°40.5°
N25C11C10S3534.4°139.2°
C11C10C4S35176.3°179.7°
C11C10C4C1177.5°180.0°
C11C10S35C6177.5°180.0°
C11C10C4H42.5°0.0°
C10C4C1H4180.0°180.0°
C4C10S35C60.8°0.3°
C10C4C1C61.0°0.1°
C10C4C1H1179.0°180.0°
S35C10C4C11.2°0.2°
C10S35C6C10.2°0.2°
S35C10C4H4178.9°179.7°
C10S35C6H6179.8°180.0°
C4C1C6S350.4°0.1°
C4C1C6H1180.0°179.9°
C4C1C6H6179.6°179.9°
S35C6C1H6180.0°179.8°
S35C6C1H1179.6°179.8°
C6C1C4H4179.0°179.9°
H22C22C17H1748.0°60.0°
H22C22C17H17A72.0°180.0°
H22C22C17H17B168.0°60.1°
H17C17H17AH17B120.0°120.0°
H3C3C2H20.2°0.1°
H21C21C20H2052.4°179.9°
H21C21C20H20A70.2°60.0°
H21AC21C20H20172.0°60.0°
H21AC21C20H20A49.5°180.0°
H20C20C23H2356.7°175.1°
H20AC20C23H23179.3°65.0°
H23C23C19H19119.1°60.0°
H23C23C19H19A0.9°180.0°
H23C23C19H19B120.9°59.9°
H23C23C18H1846.6°60.0°
H23C23C18H18A73.3°60.0°
H23C23C18H18B166.6°180.0°
H19C19H19AH19B120.0°120.0°
H18C18H18AH18B120.0°120.0°
H4C4C1H11.0°0.1°
H6C6C1H10.4°0.1°

224931

PDB entries from 2024-09-11

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