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A1L0G

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C19N7doub1.32Å1.33ÅAromatic
C19N6sing1.32Å1.36ÅAromatic
N7C20sing1.33Å1.36ÅAromatic
N6C17doub1.33Å1.35ÅAromatic
C20N8sing1.38Å1.37Å
C20C18doub1.40Å1.40ÅAromatic
C17C18sing1.41Å1.39ÅAromatic
C17N4sing1.37Å1.37ÅAromatic
C18N5sing1.35Å1.37ÅAromatic
N4C15sing1.46Å1.49Å
N4C16sing1.36Å1.35ÅAromatic
C15O5sing1.44Å1.40Å
C15C14sing1.55Å1.52Å
N5C16doub1.30Å1.35ÅAromatic
O7C14sing1.43Å1.42Å
O5C12sing1.44Å1.45Å
C14C13sing1.55Å1.51Å
C12C13sing1.54Å1.51Å
C12C11sing1.53Å1.51Å
O1C9doub1.21Å1.24Å
C13O6sing1.43Å1.43Å
O2C11sing1.43Å1.42Å
O2Ssing1.52Å1.57Å
C9C8sing1.51Å1.52Å
C9N2sing1.35Å1.31Å
C8C7sing1.53Å1.55Å
O3Sdoub1.42Å1.44Å
N3C10trip1.14Å1.17Å
SN2sing1.66Å1.59Å
SO4doub1.42Å1.43Å
C10C4sing1.43Å1.34Å
C4C5doub1.40Å1.39ÅAromatic
C4C3sing1.40Å1.38ÅAromatic
C5C6sing1.38Å1.38ÅAromatic
C3C2doub1.38Å1.38ÅAromatic
C6C7sing1.51Å1.48Å
C6C1doub1.38Å1.41ÅAromatic
C7N1sing1.47Å1.51Å
C2C1sing1.38Å1.37ÅAromatic
N2H1sing0.97Å1.00Å
C8H2sing1.09Å1.10Å
C8H3sing1.09Å1.10Å
C7H4sing1.09Å1.10Å
N1H5sing1.01Å1.00Å
N1H6sing1.01Å1.00Å
C5H8sing1.08Å1.08Å
C3H9sing1.08Å1.08Å
C2H10sing1.08Å1.08Å
C1H11sing1.08Å1.08Å
C11H12sing1.09Å1.10Å
C11H13sing1.09Å1.10Å
C12H14sing1.09Å1.10Å
C13H15sing1.09Å1.10Å
O6H16sing0.97Å0.95Å
C14H17sing1.09Å1.10Å
O7H18sing0.97Å0.95Å
C15H19sing1.09Å1.10Å
C19H20sing1.08Å1.08Å
N8H21sing0.97Å1.00Å
N8H22sing0.97Å1.00Å
C16H23sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N7C19N6124.3°122.4°
C19N7C20120.2°121.2°
N7C19H20117.9°118.8°
C19N6C17116.4°120.7°
N6C19H20117.8°118.8°
N7C20N8119.5°120.7°
N7C20C18118.1°118.5°
N6C17C18121.8°119.1°
N6C17N4130.1°134.9°
N8C20C18122.1°120.7°
C20N8H21109.5°120.0°
C20N8H22109.5°120.0°
C20C18C17118.8°118.1°
C20C18N5133.7°134.7°
C18C17N4108.0°106.0°
C17C18N5106.7°107.1°
C17N4C15122.3°126.3°
C17N4C16107.5°107.4°
C18N5C16107.8°109.4°
C15N4C16130.2°126.3°
N4C15O5107.4°110.4°
N4C15C14104.0°110.4°
N4C15H19112.1°110.4°
N4C16N5109.6°110.0°
N4C16H23125.2°125.0°
O5C15C14107.6°104.8°
C15O5C12106.6°105.3°
O5C15H19113.6°110.4°
C15C14O7105.0°110.6°
C15C14C13103.0°104.1°
C15C14H17111.4°110.5°
C14C15H19111.6°110.4°
N5C16H23125.2°125.0°
O7C14C13112.0°110.5°
O7C14H17113.0°110.5°
C14O7H18109.5°114.0°
O5C12C13107.7°104.8°
O5C12C11111.2°110.4°
O5C12H14110.0°110.5°
C14C13C1298.2°104.0°
C14C13O6113.7°110.5°
C14C13H15111.9°110.7°
C13C14H17111.7°110.5°
C13C12C11109.7°110.4°
C12C13O6106.8°110.5°
C13C12H14109.2°110.4°
C12C13H15111.9°110.5°
C12C11O2110.2°109.5°
C12C11H12109.3°109.5°
C12C11H13109.3°109.5°
C11C12H14109.1°110.3°
O1C9C8121.6°120.0°
O1C9N2120.3°120.0°
O6C13H15113.2°110.5°
C13O6H16109.5°114.0°
C11O2S113.0°114.0°
O2C11H12109.3°109.5°
O2C11H13109.3°109.5°
O2SO3105.6°106.4°
O2SN2113.1°107.2°
O2SO4106.6°106.4°
C8C9N2118.1°120.0°
C9C8C7118.2°109.4°
C9C8H2107.3°109.4°
C9C8H3107.2°109.5°
C9N2S123.2°120.0°
C9N2H1118.4°120.0°
C8C7C6109.1°109.4°
C8C7N1109.5°109.4°
C7C8H2107.2°109.4°
C7C8H3107.3°109.5°
C8C7H4108.7°109.5°
O3SN2111.0°106.4°
O3SO4111.3°123.2°
N3C10C4175.4°180.0°
N2SO4109.3°106.4°
SN2H1118.4°120.0°
C10C4C5121.0°120.2°
C10C4C3119.6°120.1°
C5C4C3119.4°119.7°
C4C5C6120.6°119.8°
C4C5H8119.7°120.1°
C4C3C2119.4°119.8°
C4C3H9120.3°120.1°
C5C6C7120.3°119.9°
C5C6C1120.1°120.2°
C6C5H8119.7°120.1°
C3C2C1122.3°120.1°
C2C3H9120.3°120.1°
C3C2H10118.8°119.9°
C7C6C1119.6°119.9°
C6C7N1110.8°109.4°
C6C7H4109.6°109.5°
C6C1C2117.9°120.3°
C6C1H11121.1°119.9°
N1C7H4109.2°109.5°
C7N1H5109.5°111.0°
C7N1H6109.5°110.9°
C1C2H10118.8°120.0°
C2C1H11121.0°119.8°
H2C8H3109.5°109.5°
H5N1H6109.5°111.1°
H12C11H13109.5°109.4°
H21N8H22109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N7C19N6H20180.0°179.9°
N7C19N6C171.4°0.1°
C19N7C20N8179.0°180.0°
C19N7C20C185.2°0.1°
N6C19N7C202.3°0.1°
C19N6C17C183.7°0.1°
C19N6C17N4179.4°180.0°
N7C20N8C18173.5°180.0°
N7C20C18C177.3°0.1°
N7C20C18N5176.0°180.0°
C20N7C19H20177.7°180.0°
N7C20N8H210.0°0.0°
N7C20N8H22120.0°180.0°
N6C17C18C206.7°0.1°
N6C17C18N4177.5°179.9°
N6C17C18N5178.2°180.0°
N6C17N4C151.4°0.1°
N6C17N4C16179.2°179.7°
C17N6C19H20178.6°180.0°
N8C20C18C17179.1°179.9°
N8C20C18N510.4°0.1°
C20N8H21H22120.0°180.0°
C20C18C17N5171.5°179.9°
C20C18C17N4175.8°180.0°
C20C18N5C16174.7°179.8°
C18C20N8H21173.5°180.0°
C18C20N8H2253.5°0.0°
C18C17N4C15178.6°179.9°
C18C17N4C161.9°0.1°
C17C18N5C165.0°0.3°
N4C17C18N54.3°0.1°
C17N4C15C16179.3°179.8°
C17N4C15O5152.1°156.2°
C17N4C15C1494.1°88.4°
C17N4C16N51.2°0.3°
C17N4C15H1926.7°33.9°
C17N4C16H23178.8°179.7°
C18N5C16N43.9°0.4°
C18N5C16H23176.0°179.7°
N4C15O5C14111.4°118.8°
N4C15O5H19124.5°122.3°
N4C15C14H19121.0°122.3°
C15N4C16N5178.1°179.9°
N4C15C14O7156.7°98.5°
N4C15O5C12107.9°159.3°
N4C15C14C1385.8°142.8°
N4C15C14H1734.0°24.2°
C15N4C16H231.9°0.1°
C16N4C15O528.6°23.5°
C16N4C15C1485.2°91.9°
N4C16N5H23180.0°179.9°
C16N4C15H19154.1°145.9°
O5C15C14H19125.3°118.8°
O5C15C14O789.6°142.7°
O5C15C14C1327.8°23.9°
C15O5C12C1322.6°40.5°
C15O5C12C11142.8°159.4°
C15O5C12H1496.3°78.4°
O5C15C14H17147.7°94.6°
C15C14O7C13111.1°114.7°
C15C14O7H17121.7°122.7°
C14C15O5C123.5°40.5°
C15C14C13H17119.7°118.6°
C15C14C13C1238.5°0.0°
C15C14C13O6150.9°118.6°
C15C14C13H1579.2°118.7°
C15C14O7H18180.0°176.1°
O7C14C13H17128.0°122.6°
O7C14C13C1273.9°118.8°
O7C14C13O638.6°0.2°
O7C14C13H15168.4°122.5°
O7C14C15H1935.7°23.8°
O5C12C13C1438.4°24.0°
O5C12C13C11121.2°118.8°
O5C12C13H14119.4°119.0°
O5C12C11H14121.5°122.3°
O5C12C13O6156.2°142.6°
O5C12C11O264.5°69.6°
O5C12C11H12175.4°50.4°
O5C12C11H1355.5°170.4°
O5C12C13H1579.3°94.8°
C12O5C15H19127.6°78.3°
C14C13C12O6117.8°118.6°
C14C13C12H15117.7°118.8°
C14C13C12C11159.6°142.9°
C14C13O6H15129.2°122.8°
C14C13C12H1480.9°94.9°
C14C13O6H16180.0°65.4°
C13C14O7H1868.9°61.4°
C13C14C15H19153.1°94.9°
C13C12C11H14119.5°122.3°
C12C13O6H15123.7°122.6°
C13C12C11O2176.4°175.0°
C13C12C11H1256.3°65.0°
C13C12C11H1363.5°54.9°
C12C13O6H1672.9°180.0°
C12C13C14H17158.1°118.7°
C11C12C13O682.6°98.6°
C12C11O2H12120.1°120.0°
C12C11O2H13120.1°120.0°
C12C11O2S179.1°180.0°
C12C11H12H13119.7°120.0°
C11C12C13H1541.9°24.1°
O1C9C8N2179.0°180.0°
O1C9C8C7156.7°0.1°
O1C9N2S4.8°0.0°
O1C9N2H1175.2°180.0°
O1C9C8H235.5°120.0°
O1C9C8H382.1°120.0°
O6C13C12H1436.9°23.6°
O6C13C14H1789.4°122.8°
C11O2SO3175.4°171.5°
C11O2SN253.8°75.0°
C11O2SO466.2°38.5°
O2C11H12H13119.6°120.0°
O2C11C12H1456.9°52.7°
O2SN2C958.7°65.0°
O2SO3N2122.9°114.1°
O2SO3O4115.2°122.9°
O2SN2O4118.5°113.5°
O2SN2H1121.3°115.0°
SO2C11H1260.8°59.9°
SO2C11H1359.0°60.0°
C9C8C7H2121.3°119.9°
C9C8C7H3121.2°120.0°
C8C9N2S176.2°180.0°
C9C8C7C6171.9°175.0°
C9C8C7N166.7°65.1°
C8C9N2H13.8°0.0°
C9C8H2H3116.1°120.0°
C9C8C7H452.4°54.9°
N2C9C8C722.3°180.0°
C9N2SO359.7°48.5°
C9N2SH1180.0°180.0°
C9N2SO4177.2°178.5°
N2C9C8H2143.5°60.0°
N2C9C8H399.0°60.0°
C8C7C6C5106.0°99.8°
C8C7C6N1120.6°119.9°
C8C7C6H4118.9°120.1°
C8C7C6C172.9°80.0°
C8C7N1H4118.8°120.1°
C7C8H2H3116.0°120.1°
C8C7N1H5180.0°59.9°
C8C7N1H660.0°64.0°
O3SN2O4123.1°133.0°
O3SN2H1120.3°131.5°
N3C10C4C573.1°4.3°
N3C10C4C3108.4°175.7°
O4SN2H12.8°1.5°
C10C4C5C3178.5°180.0°
C10C4C5C6179.3°180.0°
C10C4C3C2177.2°179.9°
C10C4C5H80.7°0.0°
C10C4C3H92.7°0.0°
C4C5C6H8180.0°180.0°
C5C4C3C21.3°0.1°
C4C5C6C7179.9°180.0°
C4C5C6C11.0°0.2°
C5C4C3H9178.8°180.0°
C3C4C5C62.2°0.1°
C4C3C2H9180.0°179.9°
C4C3C2C16.2°0.2°
C3C4C5H8177.8°180.0°
C4C3C2H10173.8°180.0°
C5C6C7C1179.0°179.7°
C5C6C7N1133.3°140.3°
C5C6C1C23.7°0.5°
C5C6C7H412.8°20.3°
C5C6C1H11176.3°179.7°
C3C2C1C67.3°0.5°
C3C2C1H10180.0°179.8°
C3C2C1H11172.7°179.7°
C6C7N1H4120.8°120.0°
C7C6C1C2175.3°179.8°
C6C7C8H250.6°55.1°
C6C7C8H366.9°65.0°
C6C7N1H559.6°60.0°
C6C7N1H660.4°176.0°
C7C6C5H80.1°0.0°
C7C6C1H114.7°0.0°
C1C6C7N147.7°40.0°
C6C1C2H11180.0°179.8°
C1C6C7H4168.2°160.0°
C1C6C5H8179.0°179.7°
C6C1C2H10172.7°179.7°
N1C7C8H2172.0°175.0°
N1C7C8H354.5°54.9°
C7N1H5H6120.0°123.9°
C1C2C3H9173.9°179.7°
H2C8C7H468.8°65.0°
H3C8C7H4173.7°175.0°
H4C7N1H561.1°180.0°
H4C7N1H6178.8°56.0°
H9C3C2H106.1°0.1°
H10C2C1H117.3°0.1°
H12C11C12H1463.2°172.7°
H13C11C12H14177.0°67.3°
H14C12C13H15161.4°146.3°
H15C13O6H1650.8°57.4°
H15C13C14H1740.5°0.1°
H17C14O7H1858.3°61.2°
H17C14C15H1987.0°146.5°

226262

PDB entries from 2024-10-16

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