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Obsolete: 8B7

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CA1OA5sing1.43Å1.49Å
CA1OA1sing1.43Å1.39Å
CA1CA2sing1.53Å1.50Å
OA1CB2sing1.43Å1.48Å
CA2CA3sing1.53Å1.50Å
CA2OA2sing1.43Å1.45Å
CA3CA4sing1.53Å1.49Å
CA3OA3sing1.43Å1.46Å
CA4OA4sing1.43Å1.45Å
CA4CA5sing1.53Å1.52Å
CA5CA6sing1.53Å1.48Å
CA5OA5sing1.43Å1.48Å
CB1OB1sing1.43Å1.40Å
CB1CB2sing1.53Å1.48Å
CB1OB5sing1.43Å1.47Å
OB1CC4sing1.43Å1.44Å
CB2CB3sing1.53Å1.45Å
CB3CB4sing1.53Å1.48Å
CB3OB3sing1.43Å1.47Å
CB4OB4sing1.43Å1.43Å
CB4CB5sing1.53Å1.53Å
CB5OB5sing1.43Å1.53Å
CB5CB6sing1.53Å1.40Å
CB6OB6sing1.43Å1.39Å
CC1CC2sing1.53Å1.44Å
CC1OC1sing1.43Å1.42Å
CC1OC5sing1.43Å1.47Å
CC2OC2sing1.43Å1.49Å
CC2CC3sing1.53Å1.45Å
CC3OC3sing1.43Å1.48Å
CC3CC4sing1.53Å1.50Å
CC4CC5sing1.53Å1.52Å
CC5OC5sing1.43Å1.52Å
CC5CC6sing1.53Å1.42Å
CC6OC6sing1.43Å1.42Å
CA1H1sing1.09Å1.10Å
CA2H2sing1.09Å1.10Å
OA2H3sing0.97Å0.95Å
CA3H4sing1.09Å1.10Å
OA3H5sing0.97Å0.95Å
CA4H6sing1.09Å1.10Å
OA4H7sing0.97Å0.95Å
CA5H8sing1.09Å1.10Å
CA6H9sing1.09Å1.10Å
CA6H10sing1.09Å1.10Å
CA6H11sing1.09Å1.10Å
CB1H12sing1.09Å1.10Å
CB2H13sing1.09Å1.10Å
CB3H14sing1.09Å1.10Å
OB3H15sing0.97Å0.95Å
CB4H16sing1.09Å1.10Å
OB4H17sing0.97Å0.95Å
CB5H18sing1.09Å1.10Å
CB6H19sing1.09Å1.10Å
CB6H20sing1.09Å1.10Å
OB6H21sing0.97Å0.95Å
CC1H22sing1.09Å1.10Å
OC1H23sing0.97Å0.95Å
CC2H24sing1.09Å1.10Å
OC2H25sing0.97Å0.95Å
CC3H26sing1.09Å1.10Å
OC3H27sing0.97Å0.95Å
CC4H28sing1.09Å1.10Å
CC5H29sing1.09Å1.10Å
CC6H30sing1.09Å1.10Å
CC6H31sing1.09Å1.10Å
OC6H32sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OA5CA1OA1103.3°109.5°
OA5CA1CA2113.5°109.4°
CA1OA5CA5113.8°114.1°
OA5CA1H1110.5°109.5°
OA1CA1CA2106.9°109.4°
CA1OA1CB2111.9°114.0°
OA1CA1H1112.1°109.4°
CA1CA2CA3111.4°109.2°
CA1CA2OA2109.6°109.5°
CA2CA1H1110.3°109.5°
CA1CA2H2108.6°109.5°
OA1CB2CB1108.2°109.5°
OA1CB2CB3106.3°109.5°
OA1CB2H13109.9°109.6°
CA3CA2OA2109.1°109.5°
CA2CA3CA4112.8°109.0°
CA2CA3OA3109.9°109.5°
CA3CA2H2108.7°109.5°
CA2CA3H4107.9°109.5°
OA2CA2H2109.4°109.6°
CA2OA2H3109.5°114.0°
CA4CA3OA3109.8°109.5°
CA3CA4OA4107.1°109.5°
CA3CA4CA5114.5°109.2°
CA4CA3H4108.0°109.6°
CA3CA4H6108.4°109.5°
OA3CA3H4108.3°109.7°
CA3OA3H5109.5°113.9°
OA4CA4CA5109.9°109.5°
OA4CA4H6108.9°109.5°
CA4OA4H7109.5°114.0°
CA4CA5CA6111.5°109.5°
CA4CA5OA5114.0°109.4°
CA5CA4H6108.0°109.6°
CA4CA5H8107.3°109.5°
CA6CA5OA5108.2°109.4°
CA6CA5H8107.8°109.5°
CA5CA6H9109.5°109.4°
CA5CA6H10109.5°109.5°
CA5CA6H11109.5°109.5°
OA5CA5H8107.8°109.5°
OB1CB1CB2106.3°109.5°
OB1CB1OB5107.6°109.5°
CB1OB1CC4113.6°114.0°
OB1CB1H12111.1°109.5°
CB2CB1OB5111.6°109.4°
CB1CB2CB3112.0°109.2°
CB2CB1H12110.0°109.5°
CB1CB2H13110.0°109.5°
CB1OB5CB5112.6°114.1°
OB5CB1H12110.1°109.5°
OB1CC4CC3104.3°109.5°
OB1CC4CC5106.2°109.6°
OB1CC4H28112.0°109.5°
CB2CB3CB4112.5°109.0°
CB2CB3OB3110.1°109.5°
CB3CB2H13110.4°109.6°
CB2CB3H14108.0°109.5°
CB4CB3OB3110.6°109.5°
CB3CB4OB4111.7°109.5°
CB3CB4CB5113.4°109.2°
CB4CB3H14107.7°109.5°
CB3CB4H16106.3°109.5°
OB3CB3H14107.8°109.7°
CB3OB3H15109.5°114.0°
OB4CB4CB5112.2°109.6°
OB4CB4H16106.9°109.5°
CB4OB4H17109.5°114.1°
CB4CB5OB5108.4°109.4°
CB4CB5CB6111.3°109.5°
CB5CB4H16105.7°109.5°
CB4CB5H18108.8°109.5°
OB5CB5CB6108.7°109.5°
OB5CB5H18108.8°109.5°
CB5CB6OB6104.5°109.4°
CB6CB5H18110.7°109.5°
CB5CB6H19110.7°109.5°
CB5CB6H20110.7°109.5°
OB6CB6H19110.7°109.5°
OB6CB6H20110.7°109.5°
CB6OB6H21109.5°113.9°
CC2CC1OC1110.1°109.5°
CC2CC1OC5107.1°109.4°
CC1CC2OC2108.9°109.5°
CC1CC2CC3109.4°109.2°
CC2CC1H22110.2°109.4°
CC1CC2H24109.2°109.5°
OC1CC1OC5109.3°109.5°
OC1CC1H22110.4°109.5°
CC1OC1H23109.5°114.0°
CC1OC5CC5111.6°114.1°
OC5CC1H22109.7°109.5°
OC2CC2CC3111.9°109.5°
OC2CC2H24108.4°109.5°
CC2OC2H25109.5°114.0°
CC2CC3OC3110.1°109.5°
CC2CC3CC4111.4°109.0°
CC3CC2H24109.0°109.6°
CC2CC3H26108.9°109.5°
OC3CC3CC4109.5°109.6°
OC3CC3H26108.5°109.5°
CC3OC3H27109.5°114.1°
CC3CC4CC5112.0°109.1°
CC4CC3H26108.3°109.7°
CC3CC4H28111.2°109.5°
CC4CC5OC5111.2°109.4°
CC4CC5CC6111.5°109.4°
CC5CC4H28110.8°109.6°
CC4CC5H29108.5°109.4°
OC5CC5CC6107.1°109.5°
OC5CC5H29108.5°109.5°
CC5CC6OC6107.4°109.5°
CC6CC5H29110.0°109.5°
CC5CC6H30110.0°109.5°
CC5CC6H31110.0°109.4°
OC6CC6H30110.0°109.5°
OC6CC6H31110.0°109.4°
CC6OC6H32109.5°114.0°
H9CA6H10109.4°109.5°
H9CA6H11109.5°109.5°
H10CA6H11109.5°109.5°
H19CB6H20109.5°109.5°
H30CC6H31109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OA5CA1OA1CA2120.1°120.0°
OA5CA1OA1H1119.0°120.0°
OA5CA1CA2H1124.6°120.1°
OA5CA1OA1CB294.3°72.0°
OA5CA1CA2CA353.3°57.6°
OA5CA1CA2OA2174.2°177.5°
CA1OA5CA5CA444.7°61.1°
CA1OA5CA5CA6169.3°178.9°
OA5CA1CA2H266.3°62.3°
CA1OA5CA5H874.4°58.9°
OA1CA1CA2H1122.1°119.9°
OA1CA1CA2CA360.0°62.4°
OA1CA1CA2OA260.9°57.5°
OA1CA1OA5CA565.3°58.9°
CA1OA1CB2CB1140.8°149.3°
CA1OA1CB2CB398.8°91.0°
OA1CA1CA2H2179.6°177.7°
CA1OA1CB2H1320.7°29.1°
CA2CA1OA1CB2145.7°168.0°
CA1CA2CA3OA2121.2°119.9°
CA1CA2CA3H2119.6°119.9°
CA1CA2OA2H2119.0°120.1°
CA1CA2CA3CA452.1°57.0°
CA1CA2CA3OA3174.9°176.8°
CA2CA1OA5CA550.1°61.1°
CA1CA2OA2H3180.0°60.0°
CA1CA2CA3H467.1°62.9°
OA1CB2CB1OB169.2°62.6°
OA1CB2CB1CB3116.8°119.9°
OA1CB2CB1H13120.1°120.2°
OA1CB2CB1OB5173.8°177.5°
OA1CB2CB3H13119.2°120.2°
OA1CB2CB3CB4172.9°176.9°
OA1CB2CB3OB363.2°63.3°
CB2OA1CA1H124.7°48.0°
OA1CB2CB1H1251.2°57.5°
OA1CB2CB3H1454.2°57.0°
CA3CA2OA2H2118.7°120.2°
CA2CA3CA4OA3122.9°119.8°
CA2CA3CA4H4119.2°119.8°
CA2CA3OA3H4117.7°120.2°
CA2CA3CA4OA474.1°62.9°
CA2CA3CA4CA548.0°57.0°
CA3CA2CA1H1177.9°177.6°
CA3CA2OA2H357.8°179.7°
CA2CA3OA3H5180.0°60.0°
CA2CA3CA4H6168.5°176.9°
OA2CA2CA3CA4173.3°176.9°
OA2CA2CA3OA363.9°63.3°
OA2CA2CA1H161.2°62.4°
OA2CA2CA3H454.1°57.0°
CA4CA3OA3H4117.7°120.3°
CA3CA4OA4CA5124.9°119.7°
CA3CA4OA4H6117.0°120.1°
CA3CA4CA5H6120.8°119.9°
CA3CA4CA5CA6167.0°177.6°
CA3CA4CA5OA544.2°57.6°
CA4CA3CA2H267.6°62.9°
CA4CA3OA3H555.3°179.5°
CA3CA4OA4H7180.0°180.0°
CA3CA4CA5H875.2°62.3°
OA3CA3CA4OA448.8°56.9°
OA3CA3CA4CA5170.9°176.8°
OA3CA3CA2H255.3°56.9°
OA3CA3CA4H668.5°63.2°
OA4CA4CA5H6118.7°120.2°
OA4CA4CA5CA646.4°57.7°
OA4CA4CA5OA576.4°62.3°
OA4CA4CA3H4166.7°177.2°
OA4CA4CA5H8164.3°177.7°
CA4CA5CA6OA5126.1°119.9°
CA4CA5CA6H8117.6°120.1°
CA4CA5OA5H8119.1°120.0°
CA5CA4CA3H471.2°62.8°
CA5CA4OA4H755.0°60.3°
CA4CA5CA6H9180.0°55.0°
CA4CA5CA6H1060.0°175.0°
CA4CA5CA6H1160.0°65.0°
CA6CA5OA5H8116.4°120.0°
CA6CA5CA4H672.3°62.5°
CA5CA6H9H10120.0°120.0°
CA5CA6H9H11120.0°120.0°
CA5CA6H10H11120.0°120.0°
CA5OA5CA1H1174.6°178.8°
OA5CA5CA4H6164.9°177.5°
OA5CA5CA6H953.9°174.9°
OA5CA5CA6H1066.1°65.1°
OA5CA5CA6H11173.9°54.9°
OB1CB1CB2OB5117.1°119.9°
OB1CB1CB2H12120.4°120.0°
OB1CB1OB5H12121.3°120.0°
OB1CB1CB2CB3174.1°177.6°
OB1CB1OB5CB5172.7°178.8°
CB1OB1CC4CC3137.1°120.2°
CB1OB1CC4CC5104.4°120.2°
OB1CB1CB2H1350.9°57.6°
CB1OB1CC4H2816.7°0.0°
CB2CB1OB5H12122.5°120.1°
CB2CB1OB1CC4167.1°172.9°
CB1CB2CB3H13122.9°119.9°
CB1CB2CB3CB455.0°57.0°
CB1CB2CB3OB3178.9°176.8°
CB2CB1OB5CB556.5°61.2°
CB1CB2CB3H1463.7°62.8°
OB5CB1OB1CC473.3°67.2°
OB5CB1CB2CB357.0°57.7°
CB1OB5CB5CB452.1°61.2°
CB1OB5CB5CB6173.2°178.9°
OB5CB1CB2H1366.1°62.3°
CB1OB5CB5H1866.1°58.8°
OB1CC4CC3CC2164.4°176.9°
OB1CC4CC3OC373.5°63.2°
OB1CC4CC3CC5114.4°119.9°
OB1CC4CC3H28121.0°120.1°
OB1CC4CC5H28121.9°120.2°
OB1CC4CC5OC5156.2°177.5°
OB1CC4CC5CC684.4°62.5°
CC4OB1CB1H1247.4°52.9°
OB1CC4CC3H2644.6°57.0°
OB1CC4CC5H2936.9°57.5°
CB2CB3CB4OB3123.5°119.8°
CB2CB3CB4H14118.9°119.8°
CB2CB3OB3H14117.6°120.3°
CB2CB3CB4OB475.0°63.0°
CB2CB3CB4CB553.0°57.0°
CB3CB2CB1H1265.5°62.4°
CB2CB3OB3H15180.0°180.0°
CB2CB3CB4H16168.8°177.0°
CB4CB3OB3H14117.5°120.3°
CB3CB4OB4CB5128.6°119.8°
CB3CB4OB4H16115.9°120.1°
CB3CB4CB5H16116.1°119.9°
CB3CB4CB5OB550.1°57.7°
CB3CB4CB5CB6169.6°177.6°
CB4CB3CB2H1367.9°62.9°
CB4CB3OB3H1555.1°60.5°
CB3CB4OB4H17180.0°180.0°
CB3CB4CB5H1868.1°62.3°
OB3CB3CB4OB448.6°56.9°
OB3CB3CB4CB5176.5°176.9°
OB3CB3CB2H1355.9°56.9°
OB3CB3CB4H1667.7°63.2°
OB4CB4CB5H16116.1°120.1°
OB4CB4CB5OB577.6°62.3°
OB4CB4CB5CB641.9°57.6°
OB4CB4CB3H14166.1°177.2°
OB4CB4CB5H18164.2°177.7°
CB4CB5OB5CB6121.2°119.9°
CB4CB5OB5H18118.2°120.0°
CB4CB5CB6H18121.2°120.1°
CB4CB5CB6OB6173.8°175.0°
CB5CB4CB3H1465.9°62.8°
CB5CB4OB4H1751.4°60.2°
CB4CB5CB6H1966.9°55.1°
CB4CB5CB6H2054.7°65.0°
OB5CB5CB6H18119.5°120.1°
OB5CB5CB6OB654.5°65.1°
CB5OB5CB1H1266.0°58.8°
OB5CB5CB4H16166.2°177.6°
OB5CB5CB6H19173.7°174.9°
OB5CB5CB6H2064.7°54.9°
CB5CB6OB6H19119.2°120.0°
CB5CB6OB6H20119.2°119.9°
CB6CB5CB4H1674.2°62.5°
CB5CB6H19H20122.3°120.0°
CB5CB6OB6H21180.0°180.0°
OB6CB6CB5H1865.0°55.0°
OB6CB6H19H20122.3°120.0°
CC2CC1OC1OC5117.4°120.0°
CC2CC1OC1H22121.9°120.0°
CC2CC1OC5H22119.5°119.9°
CC1CC2OC2CC3121.1°119.7°
CC1CC2OC2H24118.7°120.1°
CC1CC2CC3H24119.3°119.9°
CC1CC2CC3OC3174.5°176.9°
CC1CC2CC3CC463.7°57.0°
CC2CC1OC5CC562.3°61.1°
CC2CC1OC1H23180.0°180.0°
CC1CC2OC2H25180.0°60.0°
CC1CC2CC3H2655.7°63.0°
OC1CC1OC5H22121.2°120.0°
OC1CC1CC2OC249.7°62.5°
OC1CC1CC2CC3172.3°177.6°
OC1CC1OC5CC5178.4°178.8°
OC1CC1CC2H2468.5°57.6°
OC5CC1CC2OC2168.5°177.5°
OC5CC1CC2CC368.9°57.6°
CC1OC5CC5CC449.9°61.2°
CC1OC5CC5CC6171.9°178.9°
OC5CC1OC1H2362.6°60.0°
OC5CC1CC2H2450.3°62.4°
CC1OC5CC5H2969.4°58.8°
OC2CC2CC3H24119.9°120.2°
OC2CC2CC3OC353.8°63.2°
OC2CC2CC3CC4175.5°176.9°
OC2CC2CC1H2272.3°57.5°
OC2CC2CC3H2665.1°56.9°
CC2CC3OC3CC4122.9°119.6°
CC2CC3OC3H26119.1°120.1°
CC2CC3CC4H26119.8°119.9°
CC2CC3CC4CC550.0°56.9°
CC3CC2CC1H2250.3°62.4°
CC3CC2OC2H2558.9°179.7°
CC2CC3OC3H27180.0°59.9°
CC2CC3CC4H2874.6°63.0°
OC3CC3CC4H26118.1°120.2°
OC3CC3CC4CC5172.1°176.8°
OC3CC3CC2H2466.1°56.9°
OC3CC3CC4H2847.4°56.9°
CC3CC4CC5H28124.8°119.9°
CC3CC4CC5OC542.9°57.6°
CC3CC4CC5CC6162.3°177.6°
CC4CC3CC2H2455.6°63.0°
CC4CC3OC3H2757.1°179.5°
CC3CC4CC5H2976.4°62.4°
CC4CC5OC5CC6122.0°120.0°
CC4CC5OC5H29119.3°120.0°
CC4CC5CC6H29120.5°119.9°
CC4CC5CC6OC6138.5°174.0°
CC5CC4CC3H2669.8°62.9°
CC4CC5CC6H3018.9°54.0°
CC4CC5CC6H31101.8°66.1°
OC5CC5CC6H29117.7°120.1°
OC5CC5CC6OC699.6°66.0°
CC5OC5CC1H2257.2°58.8°
OC5CC5CC4H2881.9°62.3°
OC5CC5CC6H30140.7°173.9°
OC5CC5CC6H3120.0°53.9°
CC5CC6OC6H30119.7°120.0°
CC5CC6OC6H31119.7°119.9°
CC6CC5CC4H2837.5°57.7°
CC5CC6H30H31121.0°120.0°
CC5CC6OC6H32180.0°180.0°
OC6CC6CC5H2918.1°54.1°
OC6CC6H30H31120.9°120.0°
H1CA1CA2H258.3°57.7°
H2CA2OA2H361.0°60.1°
H2CA2CA3H4173.2°177.2°
H4CA3OA3H562.4°60.2°
H4CA3CA4H649.4°57.1°
H6CA4OA4H763.1°59.9°
H6CA4CA5H845.6°57.5°
H8CA5CA6H962.4°65.1°
H8CA5CA6H10177.6°54.9°
H8CA5CA6H1157.6°174.9°
H9CA6H10H11120.0°120.0°
H12CB1CB2H13171.3°177.6°
H13CB2CB3H14173.4°177.2°
H14CB3OB3H1562.4°59.7°
H14CB3CB4H1649.8°57.1°
H16CB4OB4H1764.0°59.9°
H16CB4CB5H1848.0°57.6°
H18CB5CB6H1954.3°65.0°
H18CB5CB6H20175.8°174.9°
H19CB6OB6H2160.8°60.0°
H20CB6OB6H2160.8°60.0°
H22CC1OC1H2358.1°60.0°
H22CC1CC2H24169.5°177.6°
H24CC2OC2H2561.3°60.1°
H24CC2CC3H26175.0°177.1°
H26CC3OC3H2760.9°60.1°
H26CC3CC4H28165.6°177.1°
H28CC4CC5H29158.8°177.7°
H29CC5CC6H30101.6°66.0°
H29CC5CC6H31137.7°174.0°
H30CC6OC6H3260.3°60.0°
H31CC6OC6H3260.3°60.0°

222624

PDB entries from 2024-07-17

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