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86V

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAPCAQdoub1.38Å1.35ÅAromatic
CAPCAOsing1.39Å1.52ÅAromatic
CAQCALsing1.40Å1.51ÅAromatic
OASCAOsing1.36Å1.41Å
CAOCANdoub1.39Å1.35ÅAromatic
CALCAJsing1.47Å1.52Å
CALCAMdoub1.40Å1.36ÅAromatic
CAJCAIsing1.51Å1.61Å
CAJCAKdoub1.35Å1.44Å
CARCAKsing1.51Å1.52Å
OAHCAIsing1.43Å1.34Å
OAHCAEsing1.36Å1.32Å
CAICATsing1.51Å1.39Å
CAKCAFsing1.47Å1.38Å
CAECAFdoub1.40Å1.35ÅAromatic
CAECADsing1.38Å1.40ÅAromatic
CAFCAAsing1.39Å1.39ÅAromatic
CANCAMsing1.38Å1.52ÅAromatic
CADCACdoub1.39Å1.47ÅAromatic
CAACABdoub1.38Å1.50ÅAromatic
CATCAYdoub1.38Å1.52ÅAromatic
CATCAUsing1.38Å1.37ÅAromatic
CACCABsing1.39Å1.29ÅAromatic
CACOAGsing1.36Å1.41Å
CAYCAXsing1.38Å1.37ÅAromatic
CAUCAVdoub1.38Å1.53ÅAromatic
CAXCAWdoub1.39Å1.52ÅAromatic
CAVCAWsing1.39Å1.36ÅAromatic
CAWOAZsing1.36Å1.43Å
OAZCBAsing1.43Å1.45Å
CBACBBsing1.53Å1.55Å
CBBNBCsing1.47Å1.40Å
NBCCBGsing1.49Å1.45Å
NBCCBDsing1.48Å1.45Å
CBGCBFsing1.55Å1.53Å
CBDCBEsing1.54Å1.51Å
CBFCBEsing1.55Å1.45Å
CBECBHsing1.53Å1.57Å
CBDH1sing1.09Å1.10Å
CBDH2sing1.09Å1.10Å
CBEH3sing1.09Å1.10Å
CBHH4sing1.09Å1.10Å
CBHH5sing1.09Å1.10Å
CBHH6sing1.09Å1.10Å
CBFH7sing1.09Å1.10Å
CBFH8sing1.09Å1.10Å
CBGH9sing1.09Å1.10Å
CBGH10sing1.09Å1.10Å
CBBH12sing1.09Å1.10Å
CBBH13sing1.09Å1.10Å
CBAH14sing1.09Å1.10Å
CBAH15sing1.09Å1.10Å
CAXH16sing1.08Å1.08Å
CAYH17sing1.08Å1.08Å
CAVH18sing1.08Å1.08Å
CAUH19sing1.08Å1.08Å
CAIH20sing1.09Å1.10Å
CADH21sing1.08Å1.08Å
OAGH22sing0.97Å0.95Å
CABH23sing1.08Å1.08Å
CAAH24sing1.08Å1.08Å
CARH25sing1.09Å1.10Å
CARH26sing1.09Å1.10Å
CARH27sing1.09Å1.10Å
CAMH28sing1.08Å1.08Å
CANH29sing1.08Å1.08Å
OASH30sing0.97Å0.95Å
CAPH31sing1.08Å1.08Å
CAQH32sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAQCAPCAO120.4°120.1°
CAPCAQCAL119.3°119.9°
CAQCAPH31119.8°120.0°
CAPCAQH32120.3°120.0°
CAPCAOOAS119.0°119.9°
CAPCAOCAN120.4°120.2°
CAOCAPH31119.8°119.9°
CAQCALCAJ117.2°120.1°
CAQCALCAM120.4°119.8°
CALCAQH32120.3°120.1°
OASCAOCAN120.6°119.8°
CAOOASH30109.5°114.0°
CAOCANCAM119.5°120.1°
CAOCANH29120.2°119.9°
CAJCALCAM122.3°120.1°
CALCAJCAI112.6°120.0°
CALCAJCAK125.2°119.9°
CALCAMCAN119.9°119.9°
CALCAMH28120.0°120.1°
CAICAJCAK121.2°120.1°
CAJCAIOAH103.0°110.7°
CAJCAICAT106.4°109.2°
CAJCAIH20110.3°109.2°
CAJCAKCAR121.3°120.9°
CAJCAKCAF118.1°118.1°
CARCAKCAF120.5°120.9°
CAKCARH25109.5°109.5°
CAKCARH26109.5°109.5°
CAKCARH27109.5°109.5°
CAIOAHCAE131.2°117.6°
OAHCAICAT108.0°109.2°
OAHCAIH20114.6°109.2°
OAHCAECAF119.7°119.1°
OAHCAECAD119.0°121.1°
CAICATCAY118.4°119.9°
CAICATCAU122.6°120.0°
CATCAIH20113.7°109.2°
CAKCAFCAE119.2°118.6°
CAKCAFCAA120.9°121.3°
CAFCAECAD121.3°119.8°
CAECAFCAA119.9°120.1°
CAECADCAC119.3°119.8°
CAECADH21120.4°120.1°
CAFCAACAB119.6°119.6°
CAFCAAH24120.2°120.2°
CANCAMH28120.0°120.0°
CAMCANH29120.3°120.0°
CADCACCAB120.4°120.5°
CADCACOAG119.0°119.8°
CACCADH21120.3°120.1°
CAACABCAC119.6°120.3°
CAACABH23120.2°119.8°
CABCAAH24120.2°120.3°
CAYCATCAU119.0°120.1°
CATCAYCAX120.8°120.0°
CATCAYH17119.6°120.0°
CATCAUCAV120.4°120.1°
CATCAUH19119.8°120.0°
CABCACOAG120.7°119.8°
CACCABH23120.2°119.9°
CACOAGH22109.5°114.0°
CAYCAXCAW119.7°120.0°
CAYCAXH16120.2°120.0°
CAXCAYH17119.6°120.0°
CAUCAVCAW119.7°119.9°
CAUCAVH18120.2°120.1°
CAVCAUH19119.8°119.9°
CAXCAWCAV120.4°119.9°
CAXCAWOAZ119.8°120.1°
CAWCAXH16120.2°120.0°
CAVCAWOAZ119.7°120.0°
CAWCAVH18120.2°120.0°
CAWOAZCBA116.7°117.0°
OAZCBACBB106.9°109.4°
OAZCBAH14110.1°109.5°
OAZCBAH15110.1°109.5°
CBACBBNBC110.7°109.5°
CBACBBH12109.2°109.5°
CBACBBH13109.1°109.4°
CBBCBAH14110.1°109.5°
CBBCBAH15110.1°109.5°
CBBNBCCBG112.9°111.0°
CBBNBCCBD108.8°111.0°
NBCCBBH12109.2°109.5°
NBCCBBH13109.2°109.4°
CBGNBCCBD106.9°105.8°
NBCCBGCBF103.4°103.2°
NBCCBGH9111.0°110.6°
NBCCBGH10111.0°110.8°
NBCCBDCBE104.8°107.0°
NBCCBDH1110.6°109.9°
NBCCBDH2110.7°110.1°
CBGCBFCBE104.1°102.9°
CBGCBFH7110.8°110.7°
CBGCBFH8110.8°110.9°
CBFCBGH9111.0°110.7°
CBFCBGH10111.0°110.7°
CBDCBECBF108.4°105.2°
CBDCBECBH109.4°110.3°
CBECBDH1110.6°109.9°
CBECBDH2110.6°109.9°
CBDCBEH3109.3°110.3°
CBFCBECBH111.1°110.3°
CBFCBEH3110.1°110.4°
CBECBFH7110.8°110.8°
CBECBFH8110.8°110.7°
CBHCBEH3108.5°110.3°
CBECBHH4109.5°109.5°
CBECBHH5109.5°109.5°
CBECBHH6109.5°109.5°
H1CBDH2109.5°110.0°
H4CBHH5109.4°109.4°
H4CBHH6109.5°109.5°
H5CBHH6109.5°109.5°
H7CBFH8109.5°110.6°
H9CBGH10109.5°110.6°
H12CBBH13109.5°109.5°
H14CBAH15109.4°109.5°
H25CARH26109.5°109.4°
H25CARH27109.4°109.5°
H26CARH27109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAQCAPCAOH31180.0°179.5°
CAPCAQCALH32180.0°179.5°
CAQCAPCAOOAS179.9°179.8°
CAQCAPCAOCAN0.2°0.3°
CAPCAQCALCAJ178.4°179.7°
CAPCAQCALCAM1.6°0.5°
CAOCAPCAQCAL0.6°0.5°
CAPCAOOASCAN179.9°180.0°
CAPCAOCANCAM0.0°0.0°
CAPCAOCANH29179.9°180.0°
CAPCAOOASH30180.0°90.0°
CAOCAPCAQH32179.4°179.9°
CAQCALCAJCAM176.7°179.8°
CAQCALCAJCAI57.0°64.8°
CAQCALCAJCAK134.8°115.3°
CAQCALCAMCAN1.9°0.3°
CAQCALCAMH28178.2°179.8°
CALCAQCAPH31179.4°180.0°
OASCAOCANCAM179.9°180.0°
OASCAOCANH290.1°0.0°
OASCAOCAPH310.1°0.3°
CAOCANCAMCAL1.1°0.0°
CAOCANCAMH29180.0°180.0°
CAOCANCAMH28178.9°180.0°
CANCAOOASH300.1°90.1°
CANCAOCAPH31179.8°179.8°
CALCAJCAICAK168.7°180.0°
CALCAJCAKCAR13.9°1.6°
CALCAJCAIOAH175.4°149.6°
CALCAJCAICAT71.1°90.1°
CALCAJCAKCAF163.9°178.4°
CAJCALCAMCAN178.4°180.0°
CALCAJCAIH2052.6°29.3°
CAJCALCAMH281.6°0.0°
CAJCALCAQH321.6°0.2°
CAMCALCAJCAI119.7°115.0°
CAMCALCAJCAK48.5°65.0°
CALCAMCANH28180.0°180.0°
CALCAMCANH29178.9°180.0°
CAMCALCAQH32178.3°180.0°
CAICAJCAKCAR178.9°178.4°
CAJCAIOAHCAT112.3°120.2°
CAJCAIOAHH20119.8°120.3°
CAJCAIOAHCAE33.3°46.8°
CAJCAICATH20121.6°119.4°
CAICAJCAKCAF3.4°1.6°
CAJCAICATCAY150.5°99.4°
CAJCAICATCAU28.6°80.4°
CAJCAKCARCAF177.7°180.0°
CAKCAJCAIOAH15.9°30.3°
CAKCAJCAICAT97.6°89.9°
CAJCAKCAFCAE12.4°13.7°
CAJCAKCAFCAA167.7°165.3°
CAKCAJCAIH20138.6°150.7°
CAJCAKCARH25180.0°180.0°
CAJCAKCARH2660.0°60.0°
CAJCAKCARH2760.0°60.0°
CARCAKCAFCAE169.9°166.3°
CARCAKCAFCAA10.1°14.8°
CAKCARH25H26120.0°120.0°
CAKCARH25H27120.0°120.0°
CAKCARH26H27120.0°120.0°
OAHCAICATH20128.4°119.4°
CAIOAHCAECAF28.4°34.2°
CAIOAHCAECAD150.8°146.0°
OAHCAICATCAY99.5°139.4°
OAHCAICATCAU81.4°40.8°
CAEOAHCAICAT79.0°73.4°
OAHCAECAFCAK0.2°2.3°
OAHCAECAFCAD179.1°179.8°
OAHCAECAFCAA179.8°178.7°
OAHCAECADCAC179.7°179.1°
CAEOAHCAIH20153.1°167.2°
OAHCAECADH210.3°0.8°
CAICATCAYCAU179.2°179.8°
CAICATCAYCAX180.0°180.0°
CAICATCAUCAV179.4°180.0°
CAICATCAYH170.0°0.1°
CAICATCAUH190.5°0.1°
CAKCAFCAECAA180.0°179.0°
CAKCAFCAECAD179.3°177.9°
CAKCAFCAACAB179.4°178.2°
CAKCAFCAAH240.6°1.8°
CAFCAKCARH252.3°0.0°
CAFCAKCARH26122.3°120.0°
CAFCAKCARH27117.7°120.0°
CAFCAECADCAC0.6°0.7°
CAECAFCAACAB0.7°0.7°
CAFCAECADH21179.4°179.4°
CAECAFCAAH24179.4°179.3°
CADCAECAFCAA0.7°1.1°
CAECADCACH21180.0°179.9°
CAECADCACCAB0.4°0.0°
CAECADCACOAG179.9°180.0°
CAFCAACABH24180.0°180.0°
CAFCAACABCAC0.5°0.0°
CAFCAACABH23179.5°180.0°
CADCACCABCAA0.4°0.4°
CADCACCABOAG179.6°180.0°
CADCACOAGH22180.0°90.0°
CADCACCABH23179.6°179.7°
CAACABCACH23180.0°180.0°
CAACABCACOAG180.0°179.6°
CATCAYCAXH17180.0°179.9°
CAYCATCAUCAV0.3°0.2°
CATCAYCAXCAW0.5°0.0°
CATCAYCAXH16179.5°180.0°
CAYCATCAUH19179.7°179.7°
CAYCATCAIH2028.9°19.9°
CAUCATCAYCAX0.8°0.2°
CATCAUCAVH19180.0°179.9°
CATCAUCAVCAW0.5°0.0°
CAUCATCAYH17179.2°179.7°
CATCAUCAVH18179.5°179.9°
CAUCATCAIH20150.2°160.2°
CABCACCADH21179.6°179.9°
CABCACOAGH220.3°89.9°
CACCABCAAH24179.5°180.0°
OAGCACCADH210.1°0.1°
OAGCACCABH230.0°0.3°
CAYCAXCAWH16180.0°180.0°
CAYCAXCAWCAV0.3°0.3°
CAYCAXCAWOAZ179.4°180.0°
CAUCAVCAWCAX0.8°0.3°
CAUCAVCAWH18180.0°180.0°
CAUCAVCAWOAZ179.9°180.0°
CAXCAWCAVOAZ179.1°179.7°
CAXCAWOAZCBA23.2°180.0°
CAWCAXCAYH17179.5°180.0°
CAXCAWCAVH18179.2°179.7°
CAVCAWOAZCBA157.7°0.3°
CAVCAWCAXH16179.7°179.7°
CAWCAVCAUH19179.6°179.9°
CAWOAZCBACBB173.3°180.0°
CAWOAZCBAH1467.1°60.0°
CAWOAZCBAH1553.7°60.0°
OAZCAWCAXH160.6°0.0°
OAZCAWCAVH180.1°0.0°
OAZCBACBBH14119.6°120.0°
OAZCBACBBH15119.6°120.0°
OAZCBACBBNBC84.1°65.0°
OAZCBACBBH1236.0°55.0°
OAZCBACBBH13155.7°175.0°
OAZCBAH14H15121.2°120.0°
CBACBBNBCH12120.2°120.1°
CBACBBNBCH13120.2°119.9°
CBACBBNBCCBG74.9°69.8°
CBACBBNBCCBD166.7°172.8°
CBACBBH12H13119.4°120.0°
CBBCBAH14H15121.2°120.0°
CBBNBCCBGCBD119.6°120.5°
CBBNBCCBGCBF155.4°159.7°
CBBNBCCBDCBE148.0°145.8°
CBBNBCCBDH128.8°94.8°
CBBNBCCBDH292.7°26.5°
CBBNBCCBGH985.6°41.2°
CBBNBCCBGH1036.4°81.8°
NBCCBBH12H13119.5°120.0°
NBCCBBCBAH14156.2°175.0°
NBCCBBCBAH1535.5°55.0°
NBCCBGCBFH9119.0°118.4°
NBCCBGCBFH10119.0°118.6°
CBGNBCCBDCBE25.8°25.3°
NBCCBGCBFCBE31.7°37.4°
CBGNBCCBDH193.4°144.6°
CBGNBCCBDH2145.1°94.1°
NBCCBGCBFH787.4°155.8°
NBCCBGCBFH8150.8°81.0°
NBCCBGH9H10122.8°123.1°
CBGNBCCBBH1245.3°170.1°
CBGNBCCBBH13164.9°50.1°
CBDNBCCBGCBF35.9°39.2°
NBCCBDCBEH1119.2°119.4°
NBCCBDCBEH2119.3°119.5°
NBCCBDCBECBF5.1°1.2°
NBCCBDCBECBH116.2°117.7°
NBCCBDH1H2122.2°121.4°
NBCCBDCBEH3125.1°120.2°
CBDNBCCBGH9154.9°79.3°
CBDNBCCBGH1083.1°157.7°
CBDNBCCBBH1273.2°52.7°
CBDNBCCBBH1346.5°67.3°
CBGCBFCBECBD16.3°22.0°
CBGCBFCBEH7119.1°118.4°
CBGCBFCBEH8119.1°118.5°
CBGCBFCBECBH136.5°140.9°
CBGCBFCBEH3103.3°97.0°
CBGCBFH7H8122.5°123.3°
CBFCBGH9H10122.8°123.0°
CBDCBECBFCBH120.2°118.9°
CBDCBECBFH3119.5°119.0°
CBDCBECBHH3119.2°122.1°
CBECBDH1H2122.2°121.1°
CBDCBECBHH4180.0°60.1°
CBDCBECBHH560.0°180.0°
CBDCBECBHH660.0°60.0°
CBDCBECBFH7102.9°140.3°
CBDCBECBFH8135.4°96.5°
CBFCBECBHH3121.2°122.2°
CBFCBECBDH1114.2°120.6°
CBFCBECBDH2124.3°118.3°
CBFCBECBHH460.4°55.7°
CBFCBECBHH5179.6°64.3°
CBFCBECBHH659.6°175.7°
CBECBFH7H8122.5°123.2°
CBECBFCBGH9150.7°81.0°
CBECBFCBGH1087.3°156.0°
CBHCBECBDH1124.6°1.6°
CBHCBECBDH23.0°122.8°
CBECBHH4H5120.0°120.0°
CBECBHH4H6120.0°120.1°
CBECBHH5H6120.0°120.1°
CBHCBECBFH717.3°100.8°
CBHCBECBFH8104.4°22.4°
H1CBDCBEH35.9°120.4°
H2CBDCBEH3115.6°0.7°
H3CBECBHH460.8°177.9°
H3CBECBHH559.2°57.9°
H3CBECBHH6179.2°62.1°
H3CBECBFH7137.6°21.4°
H3CBECBFH815.9°144.5°
H4CBHH5H6120.0°120.0°
H7CBFCBGH931.6°37.4°
H7CBFCBGH10153.5°85.6°
H8CBFCBGH990.2°160.6°
H8CBFCBGH1031.8°37.6°
H12CBBCBAH1483.6°65.0°
H12CBBCBAH15155.7°175.0°
H13CBBCBAH1436.0°55.0°
H13CBBCBAH1584.7°65.0°
H16CAXCAYH170.5°0.1°
H18CAVCAUH190.5°0.1°
H23CABCAAH240.5°0.1°
H25CARH26H27120.0°120.0°
H28CAMCANH291.1°0.0°
H31CAPCAQH320.6°0.5°

248335

PDB entries from 2026-01-28

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