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B8B

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
SO1doub1.42Å1.42Å
SN1sing1.74Å1.74Å
SO3doub1.54Å1.54Å
SN2sing1.60Å1.60Å
N1C2sing1.47Å1.47Å
C1C2sing1.52Å1.52Å
C1C4sing1.54Å1.54Å
C3C4sing1.65Å1.65Å
C3COsing2.05Å2.05Å
C3B16sing1.70Å1.70Å
C3B11sing1.71Å1.71Å
C3B10sing1.74Å1.74Å
C4COsing2.08Å2.08Å
C4B8sing1.73Å1.73Å
C4B15sing1.73Å1.73Å
C4B10sing1.73Å1.73Å
COC16sing2.11Å2.11Å
COB8sing2.09Å2.09Å
COC17sing2.19Å2.19Å
COB18sing2.12Å2.12Å
COB16sing2.09Å2.09Å
COB9sing2.12Å2.12Å
COB0sing2.07Å2.07Å
COB3sing2.06Å2.06Å
C16B0sing1.71Å1.71Å
B8B14sing1.79Å1.79Å
B8B15sing1.79Å1.79Å
B7B5sing1.78Å1.78Å
B7B6sing1.78Å1.78Å
B5B6sing1.78Å1.78Å
B5B4sing1.77Å1.77Å
B5B2sing1.78Å1.78Å
B5B1sing1.79Å1.79Å
B6B4sing1.77Å1.77Å
B6B0sing1.72Å1.72Å
B4B1sing1.77Å1.77Å
B4B0sing1.72Å1.72Å
B4B3sing1.74Å1.74Å
B18B2sing1.79Å1.79Å
B18B1sing1.79Å1.79Å
B18B3sing1.72Å1.72Å
B2B1sing1.78Å1.78Å
B1B3sing1.71Å1.71Å
B16B13sing1.77Å1.77Å
B16B11sing1.79Å1.79Å
B9B14sing1.79Å1.79Å
B13B11sing1.77Å1.77Å
B13B14sing1.79Å1.79Å
B13B12sing1.78Å1.78Å
B11B12sing1.78Å1.78Å
B11B10sing1.76Å1.76Å
B14B15sing1.78Å1.78Å
B14B12sing1.79Å1.79Å
B15B12sing1.78Å1.78Å
B15B10sing1.77Å1.77Å
B12B10sing1.78Å1.78Å
B0B3sing1.63Å1.63Å
N1H1sing1.00Å1.00Å
C1H2sing1.10Å1.10Å
C1H3sing1.10Å1.10Å
C2H4sing1.10Å1.10Å
C2H5sing1.10Å1.10Å
N2H6sing1.00Å1.00Å
N2H7sing1.00Å1.00Å
B9B16sing1.80Å1.80Å
B9B13sing1.80Å1.80Å
B9B8sing1.80Å1.80Å
C16B6sing1.78Å1.78Å
C16B7sing1.79Å1.79Å
C17C16sing1.78Å1.78Å
C17B7sing1.76Å1.76Å
C17B18sing1.76Å1.76Å
C17B2sing1.77Å1.77Å
B7B2sing1.80Å1.80Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1SN1108.8°108.8°
O1SO3112.9°112.9°
O1SN2114.4°114.4°
N1SO3105.2°105.2°
N1SN2101.0°101.0°
SN1C2109.3°109.3°
SN1H1109.5°109.5°
O3SN2113.3°113.3°
SN2H6109.5°109.5°
SN2H7109.4°109.4°
N1C2C1102.8°102.8°
C2N1H1109.5°109.5°
N1C2H4111.1°111.1°
N1C2H5111.1°111.1°
C2C1C4117.1°117.1°
C2C1H2107.5°107.5°
C2C1H3107.5°107.5°
C1C2H4111.1°111.1°
C1C2H5111.1°111.1°
C1C4C3121.0°121.0°
C1C4CO111.5°111.5°
C1C4B8122.9°122.9°
C1C4B15117.3°117.3°
C1C4B10113.5°113.5°
C4C1H2107.5°107.5°
C4C1H3107.5°107.5°
C4C3CO67.5°67.5°
C4C3B16112.7°112.7°
C4C3B11111.4°111.4°
C4C3B1061.2°61.2°
C3C4CO65.4°65.4°
C3C4B8109.1°109.1°
C3C4B15109.8°109.8°
C3C4B1061.8°61.8°
COC3B1667.1°67.1°
COC3B11124.6°124.6°
COC3B10124.1°124.1°
C3COC447.1°47.1°
C3COC16134.7°134.7°
C3COB883.7°83.7°
C3COC1799.1°99.1°
C3COB1895.6°95.6°
C3COB1648.5°48.5°
C3COB984.1°84.1°
C3COB0176.5°176.5°
C3COB3130.2°130.2°
B16C3B1163.1°63.1°
B16C3B10113.9°113.9°
C3B16CO64.3°64.3°
C3B16B13104.8°104.8°
C3B16B1158.7°58.7°
C3B16B9105.8°105.8°
B11C3B1061.5°61.5°
C3B11B1658.2°58.2°
C3B11B13104.2°104.2°
C3B11B12105.6°105.6°
C3B11B1059.9°59.9°
C3B10C457.0°57.0°
C3B10B1158.5°58.5°
C3B10B15104.2°104.2°
C3B10B12104.7°104.7°
COC4B865.6°65.6°
COC4B15121.9°121.9°
COC4B10122.6°122.6°
C4COC16100.6°100.6°
C4COB849.1°49.1°
C4COC1799.6°99.6°
C4COB18130.6°130.6°
C4COB1683.9°83.9°
C4COB984.9°84.9°
C4COB0136.1°136.1°
C4COB3177.2°177.2°
B8C4B1562.5°62.5°
B8C4B10113.1°113.1°
C4B8CO65.3°65.3°
C4B8B14104.9°104.9°
C4B8B1558.6°58.6°
C4B8B9106.5°106.5°
B15C4B1061.6°61.6°
C4B15B858.9°58.9°
C4B15B14105.9°105.9°
C4B15B12106.1°106.1°
C4B15B1059.2°59.2°
C4B10B11105.5°105.5°
C4B10B1559.2°59.2°
C4B10B12106.1°106.1°
C16COB896.6°96.6°
C16COC1748.9°48.9°
C16COB1884.3°84.3°
C16COB16175.4°175.4°
C16COB9130.2°130.2°
C16COB048.2°48.2°
C16COB382.1°82.1°
COC16B064.7°64.7°
COC16B6119.2°119.2°
COC16B7120.7°120.7°
COC16C1767.8°67.8°
B8COC17132.3°132.3°
B8COB18179.1°179.1°
B8COB1686.9°86.9°
B8COB950.8°50.8°
B8COB098.2°98.2°
B8COB3131.7°131.7°
COB8B14118.0°118.0°
COB8B15118.2°118.2°
COB8B965.5°65.5°
C17COB1848.3°48.3°
C17COB16130.0°130.0°
C17COB9175.5°175.5°
C17COB081.8°81.8°
C17COB381.5°81.5°
COC17C1663.3°63.3°
COC17B7117.8°117.8°
COC17B1864.0°64.0°
COC17B2118.0°118.0°
B18COB1692.2°92.2°
B18COB9128.6°128.6°
B18COB082.4°82.4°
B18COB348.5°48.5°
COB18B2120.4°120.4°
COB18B1117.6°117.6°
COB18B363.9°63.9°
COB18C1767.7°67.7°
B16COB950.5°50.5°
B16COB0128.5°128.5°
B16COB393.4°93.4°
COB16B13118.6°118.6°
COB16B11118.1°118.1°
COB16B965.4°65.4°
B9COB094.8°94.8°
B9COB394.1°94.1°
COB9B14116.7°116.7°
COB9B1664.1°64.1°
COB9B13116.1°116.1°
COB9B863.7°63.7°
B0COB346.5°46.5°
COB0C1667.1°67.1°
COB0B6124.7°124.7°
COB0B4125.1°125.1°
COB0B366.6°66.6°
COB3B4124.5°124.5°
COB3B1867.6°67.6°
COB3B1125.5°125.5°
COB3B066.9°66.9°
C16B0B662.6°62.6°
C16B0B4113.6°113.6°
C16B0B3110.2°110.2°
B0C16B659.0°59.0°
B0C16B7105.5°105.5°
B0C16C17106.2°106.2°
B14B8B1559.4°59.4°
B8B14B960.5°60.5°
B8B14B13107.5°107.5°
B8B14B1560.3°60.3°
B8B14B12108.2°108.2°
B14B8B959.6°59.6°
B8B15B1460.3°60.3°
B8B15B12108.7°108.7°
B8B15B10108.3°108.3°
B15B8B9107.6°107.6°
B5B7B659.9°59.9°
B7B5B659.9°59.9°
B7B5B4108.1°108.1°
B7B5B260.7°60.7°
B7B5B1107.8°107.8°
B5B7C16107.4°107.4°
B5B7C17107.7°107.7°
B5B7B259.5°59.5°
B7B6B560.2°60.2°
B7B6B4108.7°108.7°
B7B6B0105.5°105.5°
B7B6C1660.4°60.4°
B6B7C1659.9°59.9°
B6B7C17108.1°108.1°
B6B7B2107.3°107.3°
B6B5B459.7°59.7°
B6B5B2108.2°108.2°
B6B5B1106.8°106.8°
B5B6B460.1°60.1°
B5B6B0105.4°105.4°
B5B6C16108.0°108.0°
B4B5B2108.2°108.2°
B4B5B159.6°59.6°
B5B4B660.2°60.2°
B5B4B160.6°60.6°
B5B4B0105.2°105.2°
B5B4B3104.8°104.8°
B2B5B159.8°59.8°
B5B2B18108.4°108.4°
B5B2B160.4°60.4°
B5B2C17107.5°107.5°
B5B2B759.8°59.8°
B5B1B459.8°59.8°
B5B1B18107.8°107.8°
B5B1B259.8°59.8°
B5B1B3105.6°105.6°
B4B6B059.2°59.2°
B6B4B1108.0°108.0°
B6B4B058.9°58.9°
B6B4B3104.0°104.0°
B4B6C16108.0°108.0°
B6B0B461.8°61.8°
B6B0B3111.1°111.1°
B0B6C1658.4°58.4°
B1B4B0103.9°103.9°
B1B4B358.2°58.2°
B4B1B18108.8°108.8°
B4B1B2108.5°108.5°
B4B1B360.0°60.0°
B0B4B356.2°56.2°
B4B0B362.4°62.4°
B4B3B18113.9°113.9°
B4B3B161.9°61.9°
B4B3B061.4°61.4°
B2B18B159.5°59.5°
B2B18B3104.6°104.6°
B18B2B160.4°60.4°
B2B18C1759.8°59.8°
B18B2C1759.4°59.4°
B18B2B7106.8°106.8°
B1B18B358.1°58.1°
B18B1B260.1°60.1°
B18B1B358.8°58.8°
B1B18C17107.3°107.3°
B18B3B163.2°63.2°
B18B3B0111.1°111.1°
B3B18C17105.6°105.6°
B2B1B3105.6°105.6°
B1B2C17107.6°107.6°
B1B2B7107.5°107.5°
B1B3B0111.0°111.0°
B13B16B1159.8°59.8°
B16B13B1160.7°60.7°
B16B13B14107.9°107.9°
B16B13B12109.0°109.0°
B13B16B960.5°60.5°
B16B13B960.5°60.5°
B16B11B1359.5°59.5°
B16B11B12107.9°107.9°
B16B11B10108.5°108.5°
B11B16B9108.7°108.7°
B9B14B1360.2°60.2°
B9B14B15109.0°109.0°
B9B14B12108.8°108.8°
B14B9B16106.8°106.8°
B14B9B1360.0°60.0°
B14B9B859.9°59.9°
B11B13B14108.1°108.1°
B11B13B1260.3°60.3°
B13B11B1259.9°59.9°
B13B11B10108.1°108.1°
B11B13B9109.4°109.4°
B14B13B1260.2°60.2°
B13B14B15107.0°107.0°
B13B14B1259.5°59.5°
B14B13B959.8°59.8°
B13B12B1159.8°59.8°
B13B12B1460.3°60.3°
B13B12B15107.7°107.7°
B13B12B10107.4°107.4°
B12B13B9109.1°109.1°
B12B11B1060.2°60.2°
B11B12B14107.8°107.8°
B11B12B15107.0°107.0°
B11B12B1059.4°59.4°
B11B10B15108.3°108.3°
B11B10B1260.4°60.4°
B15B14B1259.8°59.8°
B14B15B1260.4°60.4°
B14B15B10108.5°108.5°
B14B12B1559.8°59.8°
B14B12B10107.6°107.6°
B12B15B1060.2°60.2°
B15B12B1059.6°59.6°
B15B10B1260.2°60.2°
H2C1H3109.5°109.5°
H4C2H5109.5°109.5°
H6N2H7109.4°109.4°
B16B9B1359.0°59.0°
B16B9B8106.0°106.0°
B13B9B8106.9°106.9°
B6C16B759.8°59.8°
B6C16C17107.5°107.5°
B7C16C1759.3°59.3°
C16B7C1760.0°60.0°
C16B7B2107.0°107.0°
C16C17B760.7°60.7°
C16C17B18106.6°106.6°
C16C17B2108.7°108.7°
B7C17B18109.4°109.4°
B7C17B261.1°61.1°
C17B7B259.6°59.6°
B18C17B260.8°60.8°
C17B2B759.2°59.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1SN1O3121.3°121.3°
O1SN1N2120.7°120.7°
O1SO3N2132.1°132.1°
O1SN1C250.6°50.6°
O1SN1H1170.5°170.5°
O1SN2H6180.0°180.0°
O1SN2H760.0°60.0°
N1SO3N2109.4°109.4°
SN1C2H1119.9°119.9°
SN1C2C1166.1°166.1°
SN1C2H447.2°47.2°
SN1C2H574.9°74.9°
N1SN2H663.4°63.4°
N1SN2H7176.6°176.6°
O3SN1C270.7°70.7°
O3SN1H149.3°49.3°
O3SN2H648.6°48.6°
O3SN2H771.4°71.4°
N2SN1C2171.3°171.3°
N2SN1H168.8°68.8°
SN2H6H7120.0°120.0°
N1C2C1H4118.9°118.9°
N1C2C1H5118.9°118.9°
N1C2C1C4177.2°177.2°
N1C2C1H256.1°56.1°
N1C2C1H361.7°61.7°
N1C2H4H5123.1°123.1°
C2C1C4H2121.1°121.1°
C2C1C4H3121.1°121.1°
C2C1C4C3130.9°130.9°
C2C1C4CO155.7°155.7°
C2C1C4B881.7°81.7°
C2C1C4B158.2°8.2°
C2C1C4B1060.7°60.7°
C1C2N1H173.9°73.9°
C2C1H2H3116.5°116.5°
C1C2H4H5123.1°123.1°
C1C4C3CO101.3°101.3°
C1C4C3B8151.5°151.5°
C1C4C3B15141.8°141.8°
C1C4C3B10101.9°101.9°
C1C4C3B16152.3°152.3°
C1C4C3B11138.9°138.9°
C1C4COB8117.6°117.6°
C1C4COB15145.8°145.8°
C1C4COB10139.6°139.6°
C1C4B8B15106.2°106.2°
C1C4B8B10142.5°142.5°
C1C4B15B10103.4°103.4°
C1C4COC1628.0°28.0°
C1C4COC1721.7°21.7°
C1C4COB1863.6°63.6°
C1C4COB16151.3°151.3°
C1C4COB9158.0°158.0°
C1C4COB066.4°66.4°
C1C4COB3133.2°133.2°
C1C4B8B14144.9°144.9°
C1C4B10B11148.2°148.2°
C1C4B15B14154.2°154.2°
C1C4B15B12142.6°142.6°
C1C4B10B12148.8°148.8°
C4C1H2H3116.5°116.5°
C4C1C2H463.9°63.9°
C4C1C2H558.3°58.3°
C1C4B8B9152.9°152.9°
C4C3COB16128.8°128.8°
C4C3COB11101.1°101.1°
C4C3COB1024.6°24.6°
C4C3B16B11103.4°103.4°
C4C3B16B1067.3°67.3°
C4C3B11B1036.9°36.9°
C3C4COB8127.1°127.1°
C3C4COB1598.9°98.9°
C3C4B8B15103.0°103.0°
C3C4B8B1066.7°66.7°
C3C4B15B1040.0°40.0°
C4C3COC1655.6°55.6°
C4C3COC1794.6°94.6°
C4C3COB18143.2°143.2°
C4C3COB988.5°88.5°
C4C3COB0160.0°160.0°
C4C3COB3178.9°178.9°
C3C4B8B1464.3°64.3°
C4C3B16B1363.7°63.7°
C4C3B11B1366.0°66.0°
C4C3B11B123.8°3.8°
C3C4B15B1462.4°62.4°
C3C4B15B120.7°0.7°
C3C4B10B1297.4°97.4°
C3C4C1H2108.0°108.0°
C3C4C1H39.8°9.8°
C4C3B16B90.8°0.8°
C3C4B8B92.1°2.1°
COC3B16B11154.6°154.6°
COC3B16B10118.6°118.6°
COC3B11B10113.6°113.6°
C3COC16B887.6°87.6°
C3COC16C1755.5°55.5°
C3COC16B1892.3°92.3°
C3COC16B16132.6°132.6°
C3COC16B9130.3°130.3°
C3COC16B0177.3°177.3°
C3COC16B3141.1°141.1°
C3COB8C1796.6°96.6°
C3COB8B1838.4°38.4°
C3COB8B1648.6°48.6°
C3COB8B987.6°87.6°
C3COB8B0177.0°177.0°
C3COB8B3140.4°140.4°
C3COC17B1889.4°89.4°
C3COC17B1642.2°42.2°
C3COC17B9136.2°136.2°
C3COC17B0176.6°176.6°
C3COC17B3129.6°129.6°
C3COB18B1648.5°48.5°
C3COB18B987.0°87.0°
C3COB18B0177.0°177.0°
C3COB18B3141.2°141.2°
C3COB16B9123.5°123.5°
C3COB16B0177.7°177.7°
C3COB16B3144.1°144.1°
C3COB9B0176.7°176.7°
C3COB9B3130.0°130.0°
C3COB0B319.9°19.9°
C3COB8B1458.4°58.4°
C3COB8B1510.0°10.0°
C3COB0B6120.2°120.2°
C3COB0B442.7°42.7°
C3COB3B4159.2°159.2°
C3COB18B2126.7°126.7°
C3COB18B1164.3°164.3°
C3COB3B181.5°81.5°
COC3B16B13115.0°115.0°
C3COB9B1457.7°57.7°
COC3B11B1310.7°10.7°
COC3B11B1272.9°72.9°
COC3B10B1511.4°11.4°
COC3B10B1273.8°73.8°
C3COB9B1310.2°10.2°
C3COC16B6153.8°153.8°
C3COC16B783.6°83.6°
C3COC17B7171.3°171.3°
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B2B18B3B064.9°64.9°
B18B2B7C161.4°1.4°
B2B18C17C16102.5°102.5°
B2B18C17B738.4°38.4°
B1B18B3C17100.9°100.9°
B18B1B3B0103.7°103.7°
B1B18C17C1665.2°65.2°
B1B18C17B71.1°1.1°
B3B18C17C164.4°4.4°
B3B18C17B759.7°59.7°
B3B18B2B763.0°63.0°
B2B1B3B064.5°64.5°
B1B2B7C1662.1°62.1°
B1B2C17C1661.3°61.3°
B1B2C17B7100.3°100.3°
B3B1B2C171.3°1.3°
B3B1B2B761.1°61.1°
B13B16B11B937.0°37.0°
B13B16B9B1437.7°37.7°
B16B13B11B14100.8°100.8°
B16B13B11B12138.7°138.7°
B16B13B14B12102.1°102.1°
B16B13B12B964.5°64.5°
B13B16B11B10100.6°100.6°
B16B13B14B1564.4°64.4°
B16B13B12B1562.3°62.3°
B16B13B12B100.5°0.5°
B13B16B9B8100.4°100.4°
B11B16B9B141.0°1.0°
B16B11B12B10101.5°101.5°
B16B11B12B141.2°1.2°
B16B11B12B1564.1°64.1°
B16B11B10B1562.5°62.5°
B11B16B9B863.7°63.7°
B14B9B13B11100.2°100.2°
B9B14B13B15102.6°102.6°
B9B14B13B12140.3°140.3°
B9B14B12B111.8°1.8°
B9B14B15B12101.2°101.2°
B9B14B15B1063.7°63.7°
B9B14B12B1064.5°64.5°
B11B13B14B1238.0°38.0°
B11B13B12B9102.0°102.0°
B13B11B12B10138.2°138.2°
B11B13B14B150.2°0.2°
B13B11B12B15100.9°100.9°
B13B11B10B150.5°0.5°
B11B13B9B861.5°61.5°
B14B13B11B100.5°0.5°
B13B14B15B1237.6°37.6°
B13B14B15B100.1°0.1°
B14B13B12B10100.7°100.7°
B13B12B15B10100.2°100.2°
B12B13B9B82.8°2.8°
B11B12B15B14101.0°101.0°
B11B12B14B1062.7°62.7°
B11B12B15B1037.3°37.3°
B12B11B16B90.1°0.1°
B11B10B15B140.4°0.4°
B10B11B16B963.5°63.5°
B10B11B13B964.0°64.0°
B14B15B12B10138.3°138.3°
B15B14B9B1661.9°61.9°
B12B14B9B161.7°1.7°
B15B12B13B92.2°2.2°
B12B15B8B91.0°1.0°
B10B15B8B964.8°64.8°
B10B12B13B965.0°65.0°
B3B0C16B765.0°65.0°
B3B0C16C173.1°3.1°
B0B3B18C172.7°2.7°
H1N1C2H4167.1°167.1°
H1N1C2H545.0°45.0°
H2C1C2H4175.0°175.0°
H2C1C2H562.8°62.8°
H3C1C2H457.2°57.2°
H3C1C2H5179.4°179.4°
B6C16C17B1866.5°66.5°
B6C16C17B22.4°2.4°
C16B7C17B2136.8°136.8°
B7C16C17B18103.3°103.3°

224931

PDB entries from 2024-09-11

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