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GT5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N2C1sing1.31Å1.35ÅAromatic
N2C3doub1.29Å1.35ÅAromatic
C1C6doub1.36Å1.35ÅAromatic
C3C4sing1.51Å1.53Å
C3S5sing1.71Å1.64ÅAromatic
C6C7sing1.47Å1.33Å
C6S5sing1.76Å1.62ÅAromatic
O44C7doub1.22Å1.23Å
C7N8sing1.35Å1.34Å
C43C41sing1.53Å1.54Å
C42C41sing1.53Å1.54Å
N8C9sing1.47Å1.45Å
C40C41sing1.53Å1.54Å
C40C9sing1.53Å1.52Å
C9C10sing1.51Å1.52Å
C10O39doub1.21Å1.23Å
C10N11sing1.35Å1.34Å
N11C12sing1.47Å1.46Å
C12C32sing1.53Å1.53Å
C12C13sing1.51Å1.53Å
C32O36sing1.43Å1.44Å
O31C13doub1.21Å1.23Å
C13N14sing1.35Å1.33Å
O36C34sing1.43Å1.44Å
C23C24doub1.38Å1.39ÅAromatic
C23C20sing1.38Å1.39ÅAromatic
N22C21sing1.47Å1.46Å
C21C20sing1.51Å1.40Å
C24C17sing1.38Å1.41ÅAromatic
C20C19doub1.38Å1.40ÅAromatic
N14C15sing1.47Å1.47Å
C15C16sing1.53Å1.56Å
C15C25sing1.53Å1.55Å
C17C18doub1.38Å1.40ÅAromatic
C17C16sing1.51Å1.41Å
C19C18sing1.38Å1.40ÅAromatic
C28S27sing1.81Å1.78Å
C25C26sing1.53Å1.55Å
C26S27sing1.81Å1.82Å
S27O29doub1.42Å1.52Å
S27O30doub1.42Å1.51Å
C4H1sing1.09Å1.10Å
C4H2sing1.09Å1.10Å
C4H3sing1.09Å1.10Å
C15H4sing1.09Å1.10Å
C21H5sing1.09Å1.10Å
C21H6sing1.09Å1.10Å
C24H7sing1.08Å1.08Å
C26H8sing1.09Å1.10Å
C26H9sing1.09Å1.10Å
C28H10sing1.09Å1.10Å
C28H11sing1.09Å1.10Å
C28H12sing1.09Å1.10Å
C1H13sing1.08Å1.08Å
N8H14sing0.97Å1.00Å
C9H15sing1.09Å1.10Å
C40H16sing1.09Å1.10Å
C40H17sing1.09Å1.10Å
C41H18sing1.09Å1.10Å
C43H19sing1.09Å1.10Å
C43H20sing1.09Å1.10Å
C43H21sing1.09Å1.10Å
C42H22sing1.09Å1.10Å
C42H23sing1.09Å1.10Å
C42H24sing1.09Å1.10Å
N11H25sing0.97Å1.00Å
C12H26sing1.09Å1.10Å
C32H27sing1.09Å1.10Å
C32H28sing1.09Å1.10Å
C34H29sing1.09Å1.10Å
C34H30sing1.09Å1.10Å
C34H31sing1.09Å1.10Å
N14H32sing0.97Å1.00Å
C25H33sing1.09Å1.10Å
C25H34sing1.09Å1.10Å
C16H35sing1.09Å1.10Å
C16H36sing1.09Å1.10Å
C18H37sing1.08Å1.08Å
C19H38sing1.08Å1.08Å
N22H39sing1.01Å1.00Å
N22H40sing1.01Å1.00Å
C23H42sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1N2C3111.9°117.4°
N2C1C6112.1°114.2°
N2C1H13124.0°122.9°
N2C3C4127.3°124.8°
N2C3S5111.5°110.4°
C1C6C7128.0°126.2°
C1C6S5111.8°107.7°
C6C1H13124.0°122.9°
C4C3S5121.2°124.8°
C3C4H1109.5°109.5°
C3C4H2109.5°109.5°
C3C4H3109.5°109.4°
C3S5C692.6°90.3°
C7C6S5120.1°126.1°
C6C7O44121.2°120.0°
C6C7N8113.6°120.0°
O44C7N8125.0°120.0°
C7N8C9122.1°120.0°
C7N8H14118.9°120.0°
C43C41C42110.2°109.5°
C43C41C40107.7°109.5°
C43C41H18109.2°109.5°
C41C43H19109.5°109.5°
C41C43H20109.4°109.4°
C41C43H21109.5°109.5°
C42C41C40111.5°109.5°
C42C41H18109.2°109.5°
C41C42H22109.5°109.5°
C41C42H23109.5°109.5°
C41C42H24109.4°109.4°
N8C9C40106.6°109.5°
N8C9C10105.8°109.5°
C9N8H14119.0°120.0°
N8C9H15110.7°109.5°
C41C40C9113.8°109.5°
C41C40H16108.4°109.5°
C41C40H17108.4°109.5°
C40C41H18109.1°109.5°
C40C9C10114.0°109.5°
C40C9H15109.7°109.5°
C9C40H16108.4°109.5°
C9C40H17108.4°109.5°
C9C10O39120.6°120.0°
C9C10N11113.7°120.0°
C10C9H15109.8°109.5°
O39C10N11125.6°120.0°
C10N11C12121.9°120.0°
C10N11H25119.0°120.0°
N11C12C32102.8°109.5°
N11C12C13114.3°109.5°
C12N11H25119.0°120.0°
N11C12H26110.7°109.5°
C32C12C13109.4°109.4°
C12C32O36112.0°109.5°
C32C12H26109.7°109.5°
C12C32H27108.8°109.5°
C12C32H28108.8°109.5°
C12C13O31122.0°120.0°
C12C13N14112.3°120.0°
C13C12H26109.7°109.5°
C32O36C34112.2°114.0°
O36C32H27108.8°109.5°
O36C32H28108.8°109.5°
O31C13N14125.6°120.0°
C13N14C15123.6°120.0°
C13N14H32118.2°120.0°
O36C34H29109.5°109.5°
O36C34H30109.5°109.5°
O36C34H31109.5°109.5°
C24C23C20120.4°120.0°
C23C24C17121.3°120.0°
C23C24H7119.4°120.0°
C24C23H42119.8°120.1°
C23C20C21118.4°120.0°
C23C20C19119.3°120.0°
C20C23H42119.8°119.9°
N22C21C20112.9°109.5°
N22C21H5108.6°109.5°
N22C21H6108.6°109.5°
C21N22H39109.5°111.0°
C21N22H40109.5°111.0°
C21C20C19122.3°120.0°
C20C21H5108.6°109.4°
C20C21H6108.6°109.5°
C24C17C18118.0°120.0°
C24C17C16124.6°120.0°
C17C24H7119.4°120.0°
C20C19C18120.1°120.0°
C20C19H38119.9°120.0°
N14C15C16106.9°109.5°
N14C15C25110.5°109.5°
N14C15H4109.3°109.4°
C15N14H32118.2°120.0°
C16C15C25113.8°109.5°
C15C16C17114.5°109.5°
C16C15H4108.1°109.5°
C15C16H35108.2°109.4°
C15C16H36108.2°109.5°
C15C25C26110.1°109.5°
C25C15H4108.2°109.4°
C15C25H33109.3°109.4°
C15C25H34109.3°109.5°
C18C17C16117.4°120.0°
C17C18C19120.9°120.1°
C17C18H37119.5°120.0°
C17C16H35108.2°109.5°
C17C16H36108.2°109.5°
C19C18H37119.6°120.0°
C18C19H38119.9°120.1°
C28S27C26115.0°101.9°
C28S27O29107.1°108.6°
C28S27O30110.2°108.6°
S27C28H10109.5°109.4°
S27C28H11109.4°109.4°
S27C28H12109.4°109.5°
C25C26S27116.5°109.5°
C25C26H8107.7°109.5°
C25C26H9107.7°109.4°
C26C25H33109.3°109.5°
C26C25H34109.3°109.4°
C26S27O29106.8°108.6°
C26S27O30109.5°108.6°
S27C26H8107.7°109.5°
S27C26H9107.7°109.5°
O29S27O30107.9°119.2°
H1C4H2109.4°109.5°
H1C4H3109.5°109.4°
H2C4H3109.5°109.5°
H5C21H6109.4°109.4°
H8C26H9109.5°109.4°
H10C28H11109.5°109.5°
H10C28H12109.5°109.5°
H11C28H12109.5°109.5°
H16C40H17109.5°109.4°
H19C43H20109.4°109.5°
H19C43H21109.5°109.5°
H20C43H21109.5°109.5°
H22C42H23109.5°109.5°
H22C42H24109.5°109.5°
H23C42H24109.5°109.5°
H27C32H28109.5°109.5°
H29C34H30109.5°109.5°
H29C34H31109.4°109.4°
H30C34H31109.5°109.5°
H33C25H34109.5°109.5°
H35C16H36109.5°109.5°
H39N22H40109.4°110.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N2C1C6H13180.0°180.0°
C1N2C3C4179.2°179.9°
C1N2C3S50.1°0.1°
N2C1C6C7179.1°180.0°
N2C1C6S50.2°0.2°
C3N2C1C60.2°0.1°
N2C3C4S5179.2°179.7°
N2C3S5C60.0°0.2°
N2C3C4H10.0°89.8°
N2C3C4H2120.0°30.3°
N2C3C4H3120.0°150.3°
C3N2C1H13179.8°180.0°
C1C6S5C30.1°0.2°
C1C6C7S5178.8°179.7°
C1C6C7O4418.5°0.2°
C1C6C7N8167.0°179.7°
C4C3S5C6179.3°180.0°
C3C4H1H2120.0°120.1°
C3C4H1H3120.0°119.9°
C3C4H2H3120.0°120.0°
C3S5C6C7179.1°180.0°
S5C3C4H1179.2°89.9°
S5C3C4H259.2°150.0°
S5C3C4H360.8°30.0°
C6C7O44N8173.8°180.0°
C6C7N8C9178.3°180.0°
C7C6C1H130.9°0.0°
C6C7N8H141.7°0.0°
S5C6C7O44160.3°180.0°
S5C6C7N814.2°0.0°
S5C6C1H13179.8°179.8°
O44C7N8C94.1°0.0°
O44C7N8H14175.9°180.0°
C7N8C9H14180.0°180.0°
C7N8C9C40121.9°85.0°
C7N8C9C10116.4°155.0°
C7N8C9H152.6°35.0°
C43C41C42C40119.5°120.0°
C43C41C42H18119.8°120.0°
C43C41C40H18118.4°120.0°
C43C41C40C9179.9°175.0°
C43C41C40H1659.3°55.0°
C43C41C40H1759.4°65.0°
C41C43H19H20120.0°120.0°
C41C43H19H21120.0°120.0°
C41C43H20H21120.0°120.0°
C43C41C42H22180.0°60.0°
C43C41C42H2360.0°180.0°
C43C41C42H2460.0°60.0°
C42C41C40H18120.6°120.0°
C42C41C40C959.1°65.0°
C42C41C40H16179.7°175.0°
C42C41C40H1761.5°55.0°
C42C41C43H19180.0°60.0°
C42C41C43H2060.0°60.0°
C42C41C43H2160.0°180.0°
C41C42H22H23120.0°120.0°
C41C42H22H24120.0°120.0°
C41C42H23H24120.0°120.0°
N8C9C40C41167.8°65.0°
N8C9C40C10116.4°120.0°
N8C9C40H15119.9°120.0°
N8C9C10H15119.5°120.0°
N8C9C10O3949.1°0.0°
N8C9C10N11127.9°180.0°
N8C9C40H1671.6°55.0°
N8C9C40H1747.1°175.0°
C41C40C9H16120.6°120.0°
C41C40C9H17120.7°120.1°
C41C40C9C1075.8°175.0°
C41C40C9H1547.8°55.0°
C41C40H16H17118.1°120.0°
C40C41C43H1958.2°60.0°
C40C41C43H20178.2°180.0°
C40C41C43H2161.8°60.0°
C40C41C42H2260.5°60.0°
C40C41C42H2359.6°60.0°
C40C41C42H24179.6°180.0°
C40C9C10H15123.6°120.0°
C40C9C10O3967.8°120.0°
C40C9C10N11115.2°60.0°
C40C9N8H1458.1°95.0°
C9C40H16H17118.0°120.0°
C9C40C41H1861.6°55.0°
C9C10O39N11176.6°180.0°
C9C10N11C12172.9°180.0°
C10C9N8H1463.7°25.0°
C10C9C40H1644.8°65.0°
C10C9C40H17163.5°55.0°
C9C10N11H257.1°0.0°
O39C10N11C124.0°0.0°
O39C10C9H15168.6°119.9°
O39C10N11H25176.0°180.0°
C10N11C12H25180.0°180.0°
C10N11C12C32104.0°85.0°
C10N11C12C13137.6°155.0°
N11C10C9H158.4°60.0°
C10N11C12H2613.1°35.0°
N11C12C32C13121.8°120.0°
N11C12C32H26117.8°120.0°
N11C12C13H26125.1°120.0°
N11C12C32O36179.4°65.0°
N11C12C13O3136.1°0.0°
N11C12C13N14146.5°180.0°
N11C12C32H2760.2°175.0°
N11C12C32H2859.0°55.0°
C32C12C13H26120.3°120.0°
C12C32O36H27120.4°120.0°
C12C32O36H28120.4°120.0°
C32C12C13O3178.4°120.0°
C32C12C13N1498.9°60.0°
C12C32O36C34156.6°180.0°
C32C12N11H2576.0°95.0°
C12C32H27H28118.8°120.0°
C13C12C32O3657.6°55.0°
C12C13O31N14177.0°179.9°
C12C13N14C15177.2°180.0°
C13C12N11H2542.3°25.0°
C13C12C32H27178.0°65.0°
C13C12C32H2862.8°175.0°
C12C13N14H322.7°0.1°
O36C32C12H2662.8°175.0°
O36C32H27H28118.9°120.0°
C32O36C34H29180.0°60.1°
C32O36C34H3060.0°60.0°
C32O36C34H3160.0°180.0°
O31C13N14C150.0°0.1°
O31C13C12H26161.2°120.0°
O31C13N14H32179.9°180.0°
C13N14C15H32180.0°179.9°
C13N14C15C16144.9°155.0°
C13N14C15C2590.9°84.9°
C13N14C15H428.1°35.0°
N14C13C12H2621.4°59.9°
C34O36C32H2736.2°60.0°
C34O36C32H2883.0°60.0°
O36C34H29H30120.0°120.0°
O36C34H29H31120.0°120.0°
O36C34H30H31120.0°120.0°
C24C23C20H42180.0°179.4°
C24C23C20C21179.4°179.7°
C23C24C17H7180.0°179.9°
C24C23C20C190.2°0.9°
C23C24C17C180.6°0.1°
C23C24C17C16179.4°179.7°
C23C20C21N22132.3°89.4°
C23C20C21C19179.2°179.4°
C20C23C24C170.3°0.7°
C23C20C19C180.4°0.6°
C23C20C21H511.7°30.6°
C23C20C21H6107.2°150.6°
C20C23C24H7179.6°179.4°
C23C20C19H38179.6°180.0°
N22C21C20H5120.5°120.0°
N22C21C20H6120.5°120.0°
N22C21C20C1948.6°90.0°
N22C21H5H6118.4°120.0°
C21N22H39H40120.0°123.9°
C21C20C19C18179.6°180.0°
C20C21H5H6118.4°120.0°
C21C20C19H380.4°0.6°
C20C21N22H39180.0°180.0°
C20C21N22H4060.0°56.1°
C21C20C23H420.6°0.3°
C24C17C16C156.2°90.2°
C24C17C18C16178.9°179.8°
C24C17C18C190.3°0.2°
C24C17C16H35126.9°149.8°
C24C17C16H36114.5°29.8°
C24C17C18H37179.7°179.8°
C17C24C23H42179.7°180.0°
C20C19C18C170.2°0.0°
C20C19C18H38180.0°179.4°
C19C20C21H5169.1°150.0°
C19C20C21H671.9°30.0°
C20C19C18H37179.8°180.0°
C19C20C23H42179.8°179.7°
N14C15C16C25122.2°120.1°
N14C15C16H4117.6°120.0°
N14C15C25H4119.6°120.0°
N14C15C16C1773.7°65.0°
N14C15C25C2644.5°65.0°
N14C15C25H3375.6°175.0°
N14C15C25H34164.6°55.0°
N14C15C16H3547.0°55.0°
N14C15C16H36165.5°175.0°
C16C15C25H4120.1°120.0°
C15C16C17C18174.9°90.0°
C15C16C17H35120.7°119.9°
C15C16C17H36120.7°120.0°
C16C15C25C2675.7°175.0°
C16C15N14H3235.1°25.1°
C16C15C25H33164.2°55.0°
C16C15C25H3444.3°65.0°
C15C16H35H36117.7°120.0°
C25C15C16C17164.0°175.0°
C15C25C26H33120.1°120.0°
C15C25C26H34120.1°120.0°
C15C25C26S27154.4°180.0°
C15C25C26H884.6°59.9°
C15C25C26H933.4°60.0°
C25C15N14H3289.1°95.0°
C15C25H33H34119.7°120.0°
C25C15C16H3575.3°65.0°
C25C15C16H3643.3°55.0°
C17C18C19H37180.0°180.0°
C18C17C24H7179.4°180.0°
C18C17C16H3554.2°30.0°
C18C17C16H3664.3°150.0°
C17C18C19H38179.8°179.4°
C16C17C18C19179.2°180.0°
C17C16C15H443.8°55.0°
C16C17C24H70.6°0.2°
C17C16H35H36117.7°120.0°
C16C17C18H370.8°0.0°
C28S27C26C2556.4°180.0°
C28S27C26O29118.7°114.5°
C28S27C26O30124.7°114.5°
C28S27O29O30118.7°125.0°
C28S27C26H8177.4°60.0°
C28S27C26H964.6°60.0°
S27C28H10H11120.0°119.9°
S27C28H10H12120.0°120.0°
S27C28H11H12120.0°120.0°
C25C26S27H8121.0°120.1°
C25C26S27H9121.0°120.0°
C25C26S27O29175.1°65.5°
C25C26S27O3068.3°65.5°
C26C25C15H4164.1°55.0°
C25C26H8H9116.8°119.9°
C26C25H33H34119.7°120.0°
C26S27O29O30117.7°124.9°
S27C26H8H9116.8°120.0°
C26S27C28H10180.0°60.0°
C26S27C28H1160.0°180.0°
C26S27C28H1260.0°60.0°
S27C26C25H3334.3°60.0°
S27C26C25H3485.5°60.0°
O29S27C26H863.9°174.5°
O29S27C26H954.1°54.5°
O29S27C28H1061.5°54.5°
O29S27C28H1158.5°65.5°
O29S27C28H12178.5°174.5°
O30S27C26H852.7°54.5°
O30S27C26H9170.7°174.5°
O30S27C28H1055.6°174.5°
O30S27C28H11175.6°65.5°
O30S27C28H1264.4°54.5°
H1C4H2H3120.0°120.0°
H4C15N14H32151.9°145.0°
H4C15C25H3344.0°65.0°
H4C15C25H3475.8°175.0°
H4C15C16H35164.6°175.0°
H4C15C16H3676.9°65.0°
H5C21N22H3959.5°60.0°
H5C21N22H4060.5°176.1°
H6C21N22H3959.5°60.0°
H6C21N22H40179.5°63.9°
H7C24C23H420.4°0.1°
H8C26C25H33155.3°179.9°
H8C26C25H3435.5°60.1°
H9C26C25H3386.8°60.0°
H9C26C25H34153.4°NaN°
H10C28H11H12120.1°120.1°
H14N8C9H15177.4°145.0°
H15C9C40H16168.4°175.0°
H15C9C40H1772.8°65.1°
H16C40C41H1859.1°65.0°
H17C40C41H18177.8°175.0°
H18C41C43H1960.1°180.0°
H18C41C43H2059.8°60.0°
H18C41C43H21179.9°60.0°
H18C41C42H2260.2°180.0°
H18C41C42H23179.8°60.0°
H18C41C42H2459.8°59.9°
H19C43H20H21120.0°120.0°
H22C42H23H24120.0°120.0°
H25N11C12H26166.9°145.0°
H26C12C32H2757.6°55.0°
H26C12C32H28176.9°65.0°
H29C34H30H31120.0°120.0°
H37C18C19H380.2°0.6°

221051

PDB entries from 2024-06-12

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