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39B

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1C2sing1.36Å1.36ÅAromatic
C2N3doub1.33Å1.33ÅAromatic
N3C4sing1.33Å1.33ÅAromatic
C4C5doub1.44Å1.44ÅAromatic
N1C6doub1.41Å1.41ÅAromatic
C5C6sing1.37Å1.37ÅAromatic
C2N2'sing1.35Å1.35Å
C4N4'sing1.37Å1.37Å
C6C6'sing1.53Å1.53Å
C5C5'sing1.52Å1.52Å
C5'C1Csing1.53Å1.53Å
C1CC2Csing1.55Å1.55Å
C1CB4sing1.59Å1.59Å
C1CB5sing1.72Å1.72Å
B4B5sing1.75Å1.75Å
C1CB6sing1.74Å1.74Å
C2CB6sing1.72Å1.72Å
B5B6sing1.75Å1.75Å
C2CB7sing1.72Å1.72Å
B6B7sing1.75Å1.75Å
C2CB8sing1.63Å1.63Å
B7B8sing1.77Å1.77Å
B9B10sing1.78Å1.78Å
B4B10sing1.75Å1.75Å
B5B10sing1.74Å1.74Å
B10B11sing1.76Å1.76Å
B5B11sing1.75Å1.75Å
B6B11sing1.76Å1.76Å
B7B11sing1.77Å1.77Å
B8B12sing1.77Å1.77Å
B9B12sing1.75Å1.75Å
B10B12sing1.79Å1.79Å
B11B12sing1.78Å1.78Å
B7B12sing1.77Å1.77Å
N2'H2'1sing1.00Å1.00Å
N2'H2'2sing1.00Å1.00Å
N4'H4'1sing1.00Å1.00Å
N4'H4'2sing1.00Å1.00Å
C5'H5'1sing1.10Å1.10Å
C5'H5'2sing1.10Å1.10Å
C6'H6'1sing1.10Å1.10Å
C6'H6'2sing1.10Å1.10Å
C6'H6'3sing1.10Å1.10Å
B8B9sing1.81Å1.81Å
B4B9sing1.80Å1.80Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N1C2N3123.3°123.3°
C2N1C6118.6°118.6°
N1C2N2'117.9°117.9°
C2N3C4119.0°119.0°
N3C2N2'118.5°118.5°
N3C4C5122.7°122.7°
N3C4N4'116.1°116.1°
C4C5C6115.9°115.9°
C5C4N4'121.2°121.2°
C4C5C5'122.7°122.7°
N1C6C5120.5°120.5°
N1C6C6'114.8°114.8°
C5C6C6'124.7°124.7°
C6C5C5'121.3°121.3°
C2N2'H2'1109.5°109.5°
C2N2'H2'2109.4°109.5°
C4N4'H4'1109.5°109.5°
C4N4'H4'2109.4°109.4°
C6C6'H6'1109.5°109.5°
C6C6'H6'2109.5°109.5°
C6C6'H6'3109.5°109.5°
C5C5'C1C118.9°118.9°
C5C5'H5'1107.1°107.1°
C5C5'H5'2107.1°107.1°
C5'C1CC2C119.2°119.2°
C5'C1CB4118.9°118.9°
C5'C1CB5118.0°118.0°
C5'C1CB6115.8°115.8°
C1CC5'H5'1107.1°107.1°
C1CC5'H5'2107.0°107.0°
C2CC1CB4113.2°113.2°
C2CC1CB5111.8°111.8°
C2CC1CB662.9°62.9°
C1CC2CB663.8°63.8°
C1CC2CB7112.1°112.1°
C1CC2CB8112.8°112.8°
B4C1CB563.7°63.7°
C1CB4B561.8°61.8°
B4C1CB6114.7°114.7°
C1CB4B10107.0°107.0°
C1CB4B9106.6°106.6°
C1CB5B454.5°54.5°
B5C1CB660.8°60.8°
C1CB5B660.0°60.0°
C1CB5B10101.8°101.8°
C1CB5B11104.4°104.4°
B4B5B6106.4°106.4°
B5B4B1059.6°59.6°
B4B5B1060.1°60.1°
B4B5B11107.7°107.7°
B5B4B9109.2°109.2°
C1CB6C2C53.3°53.3°
C1CB6B559.2°59.2°
C1CB6B7102.4°102.4°
C1CB6B11103.3°103.3°
C2CB6B5102.7°102.7°
B6C2CB761.0°61.0°
C2CB6B759.3°59.3°
B6C2CB8115.3°115.3°
C2CB6B11104.2°104.2°
B5B6B7108.5°108.5°
B6B5B10108.6°108.6°
B6B5B1160.4°60.4°
B5B6B1159.7°59.7°
C2CB7B659.7°59.7°
B7C2CB863.7°63.7°
C2CB7B855.7°55.7°
C2CB7B11103.9°103.9°
C2CB7B12101.7°101.7°
B6B7B8107.4°107.4°
B7B6B1160.7°60.7°
B6B7B1160.0°60.0°
B6B7B12108.1°108.1°
C2CB8B760.7°60.7°
C2CB8B12105.4°105.4°
C2CB8B9105.0°105.0°
B8B7B11108.3°108.3°
B7B8B1260.1°60.1°
B8B7B1260.2°60.2°
B7B8B9107.7°107.7°
B9B10B461.3°61.3°
B9B10B5110.7°110.7°
B9B10B11108.9°108.9°
B10B9B1261.1°61.1°
B9B10B1258.6°58.6°
B10B9B8106.6°106.6°
B10B9B458.6°58.6°
B4B10B560.3°60.3°
B4B10B11107.3°107.3°
B4B10B12106.0°106.0°
B10B4B960.1°60.1°
B5B10B1159.9°59.9°
B10B5B1160.6°60.6°
B5B10B12107.9°107.9°
B10B11B559.4°59.4°
B10B11B6107.3°107.3°
B10B11B7108.2°108.2°
B11B10B1260.3°60.3°
B10B11B1260.7°60.7°
B5B11B659.9°59.9°
B5B11B7107.5°107.5°
B5B11B12107.8°107.8°
B6B11B759.3°59.3°
B6B11B12107.1°107.1°
B7B11B1259.8°59.8°
B11B7B1260.4°60.4°
B8B12B962.0°62.0°
B8B12B10107.7°107.7°
B8B12B11107.5°107.5°
B8B12B759.7°59.7°
B12B8B958.3°58.3°
B9B12B1060.3°60.3°
B9B12B11109.2°109.2°
B9B12B7110.5°110.5°
B12B9B859.7°59.7°
B12B9B4105.8°105.8°
B10B12B1159.0°59.0°
B10B12B7106.9°106.9°
B11B12B759.8°59.8°
H2'1N2'H2'2109.4°109.4°
H4'1N4'H4'2109.5°109.5°
H5'1C5'H5'2109.5°109.5°
H6'1C6'H6'2109.5°109.5°
H6'1C6'H6'3109.5°109.5°
H6'2C6'H6'3109.4°109.4°
B8B9B4102.3°102.3°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N1C2N3N2'174.4°174.4°
N1C2N3C41.6°1.6°
C2N1C6C50.7°0.7°
C2N1C6C6'178.6°178.6°
N1C2N2'H2'10.0°0.0°
N1C2N2'H2'2120.0°120.0°
C2N3C4C51.7°1.7°
N3C2N1C60.4°0.4°
C2N3C4N4'178.7°178.7°
N3C2N2'H2'1174.7°174.7°
N3C2N2'H2'254.7°54.7°
N3C4C5N4'179.6°179.6°
N3C4C5C60.6°0.6°
C4N3C2N2'176.0°176.0°
N3C4C5C5'175.8°175.8°
N3C4N4'H4'10.0°0.0°
N3C4N4'H4'2120.0°120.0°
C4C5C6N10.6°0.6°
C4C5C6C5'176.5°176.5°
C4C5C6C6'178.7°178.7°
C4C5C5'C1C98.8°98.8°
C5C4N4'H4'1179.6°179.6°
C5C4N4'H4'259.6°59.6°
C4C5C5'H5'122.5°22.5°
C4C5C5'H5'2139.9°139.9°
N1C6C5C6'179.2°179.2°
C6N1C2N2'174.9°174.9°
N1C6C5C5'177.0°177.0°
N1C6C6'H6'10.0°0.0°
N1C6C6'H6'2120.0°120.0°
N1C6C6'H6'3120.0°120.0°
C6C5C4N4'179.8°179.8°
C6C5C5'C1C85.0°85.0°
C6C5C5'H5'1153.7°153.7°
C6C5C5'H5'236.3°36.3°
C5C6C6'H6'1179.2°179.2°
C5C6C6'H6'260.7°60.7°
C5C6C6'H6'359.2°59.2°
C2N2'H2'1H2'2120.0°120.0°
N4'C4C5C5'3.8°3.8°
C4N4'H4'1H4'2120.0°120.0°
C6'C6C5C5'2.2°2.2°
C6C6'H6'1H6'2120.0°120.0°
C6C6'H6'1H6'3120.0°120.0°
C6C6'H6'2H6'3120.0°120.0°
C5C5'C1CH5'1121.3°121.3°
C5C5'C1CH5'2121.3°121.3°
C5C5'C1CC2C118.5°118.5°
C5C5'C1CB426.8°26.8°
C5C5'C1CB5100.5°100.5°
C5C5'C1CB6169.6°169.6°
C5C5'H5'1H5'2115.8°115.8°
C5'C1CC2CB4147.2°147.2°
C5'C1CC2CB5143.3°143.3°
C5'C1CC2CB6105.9°105.9°
C5'C1CB4B5108.9°108.9°
C5'C1CB4B6143.1°143.1°
C5'C1CB5B6105.5°105.5°
C5'C1CC2CB7144.3°144.3°
C5'C1CB6B7146.6°146.6°
C5'C1CC2CB8146.1°146.1°
C5'C1CB4B10149.1°149.1°
C5'C1CB5B10149.6°149.6°
C5'C1CB5B11148.0°148.0°
C5'C1CB6B11151.0°151.0°
C1CC5'H5'1H5'2115.7°115.7°
C5'C1CB4B9147.8°147.8°
C2CC1CB4B5103.8°103.8°
C2CC1CB4B669.6°69.6°
C2CC1CB5B638.2°38.2°
C1CC2CB6B7138.8°138.8°
C1CC2CB6B8104.2°104.2°
C1CC2CB7B8105.4°105.4°
C2CC1CB4B1063.6°63.6°
C2CC1CB5B1066.6°66.6°
C2CC1CB5B114.2°4.2°
C2CC1CB6B1197.9°97.9°
C1CC2CB7B112.5°2.5°
C1CC2CB8B1262.7°62.7°
C1CC2CB7B1264.6°64.6°
C2CC1CC5'H5'1120.2°120.2°
C2CC1CC5'H5'22.9°2.9°
C1CC2CB8B92.1°2.1°
C2CC1CB4B90.5°0.5°
B4C1CB5B6144.2°144.2°
C1CB4B5B10134.3°134.3°
C1CB4B5B999.1°99.1°
B4C1CC2CB768.5°68.5°
B4C1CB6B769.1°69.1°
B4C1CC2CB81.1°1.1°
C1CB4B10B999.8°99.8°
C1CB4B10B112.7°2.7°
B4C1CB5B11101.7°101.7°
B4C1CB6B116.7°6.7°
C1CB4B9B1260.0°60.0°
C1CB4B10B1260.5°60.5°
B4C1CC5'H5'194.5°94.5°
B4C1CC5'H5'2148.2°148.2°
C1CB4B9B81.7°1.7°
C1CB5B6B1093.1°93.1°
C1CB5B6B11131.2°131.2°
B5C1CC2CB71.1°1.1°
B5C1CB6B7104.3°104.3°
B5C1CC2CB870.7°70.7°
C1CB5B10B90.4°0.4°
C1CB5B10B11100.0°100.0°
C1CB5B11B75.6°5.6°
C1CB5B10B1262.1°62.1°
C1CB5B11B1257.5°57.5°
B5C1CC5'H5'120.8°20.8°
B5C1CC5'H5'2138.2°138.2°
B4B5B6C2C2.3°2.3°
B4B5B6B1063.3°63.3°
B4B5B6B11101.4°101.4°
B4B5B6B763.9°63.9°
B5B4B9B1035.1°35.1°
B4B5B10B11136.5°136.5°
B4B5B11B762.4°62.4°
B5B4B9B125.3°5.3°
B5B4B10B12101.8°101.8°
B4B5B11B120.7°0.7°
B5B4B9B867.0°67.0°
C1CB6B7B1198.5°98.5°
C1CB6B7B83.0°3.0°
B6C1CB4B106.0°6.0°
C1CB6B11B104.4°4.4°
C1CB6B11B1259.4°59.4°
C1CB6B7B1260.5°60.5°
B6C1CC5'H5'148.2°48.2°
B6C1CC5'H5'269.1°69.1°
B6C1CB4B969.1°69.1°
C2CB6B5B761.6°61.6°
C2CB6B5B1199.1°99.1°
B6C2CB7B8145.0°145.0°
C2CB6B7B11131.2°131.2°
C2CB6B5B1061.0°61.0°
C2CB6B11B1059.5°59.5°
B6C2CB8B127.9°7.9°
C2CB6B11B124.4°4.4°
B6C2CB7B12104.2°104.2°
B6C2CB8B968.5°68.5°
B5B6B7B1137.1°37.1°
B5B6C2CB869.6°69.6°
B5B6B7B864.4°64.4°
B6B5B10B962.5°62.5°
B6B5B10B1138.0°38.0°
B6B5B10B120.0°0.0°
B6B5B11B1299.8°99.8°
B5B6B7B120.9°0.9°
B6B5B4B967.2°67.2°
C2CB7B8B1194.6°94.6°
C2CB7B8B12132.4°132.4°
C2CB7B11B1057.7°57.7°
C2CB7B11B55.0°5.0°
C2CB7B11B1295.7°95.7°
C2CB7B12B91.4°1.4°
C2CB7B12B1062.5°62.5°
B7C2CB8B9102.2°102.2°
B6B7B8B1163.4°63.4°
B6B7B8B12101.2°101.2°
B7B6B5B100.5°0.5°
B6B7B11B1099.7°99.7°
B6B7B11B12137.7°137.7°
B6B7B12B963.1°63.1°
B6B7B12B100.9°0.9°
B6B7B8B966.4°66.4°
C2CB8B9B1058.4°58.4°
B8C2CB6B118.0°8.0°
C2CB8B12B998.4°98.4°
C2CB8B12B1057.7°57.7°
C2CB8B12B114.5°4.5°
C2CB8B9B42.2°2.2°
B7B8B9B105.1°5.1°
B8B7B11B100.2°0.2°
B8B7B11B563.0°63.0°
B8B7B11B1237.8°37.8°
B7B8B12B9140.2°140.2°
B7B8B12B1099.6°99.6°
B7B8B9B465.7°65.7°
B9B10B4B11102.5°102.5°
B9B10B4B1239.2°39.2°
B9B10B5B11100.4°100.4°
B9B10B5B1262.5°62.5°
B9B10B11B1234.1°34.1°
B9B10B11B666.1°66.1°
B9B10B11B73.5°3.5°
B10B9B8B1240.7°40.7°
B9B10B12B7104.3°104.3°
B10B9B8B460.6°60.6°
B4B10B11B1298.9°98.9°
B4B10B11B61.3°1.3°
B4B10B11B761.3°61.3°
B4B10B12B81.0°1.0°
B4B10B12B763.8°63.8°
B5B10B11B12137.6°137.6°
B5B10B11B7100.0°100.0°
B5B10B12B862.3°62.3°
B5B10B12B70.5°0.5°
B5B10B9B858.8°58.8°
B10B11B6B1263.8°63.8°
B10B11B7B1238.0°38.0°
B10B11B12B8100.5°100.5°
B11B10B9B85.3°5.3°
B5B11B7B12100.8°100.8°
B5B11B12B863.0°63.0°
B5B11B12B92.7°2.7°
B11B5B4B93.7°3.7°
B6B11B12B80.1°0.1°
B6B11B12B965.8°65.8°
B7B11B12B9103.0°103.0°
B11B7B8B93.0°3.0°
B8B12B9B11100.1°100.1°
B8B12B9B495.2°95.2°
B11B12B9B44.8°4.8°
B7B12B9B459.1°59.1°
H6'1C6'H6'2H6'3120.0°120.0°

225946

PDB entries from 2024-10-09

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