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NJN

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAENAFdoub1.32Å1.38ÅAromatic
CAECADsing1.39Å1.37ÅAromatic
NAFCAGsing1.33Å1.34ÅAromatic
NAKNALsing1.29Å1.27ÅAromatic
NAKCAJdoub1.31Å1.34ÅAromatic
OACCADsing1.36Å1.37Å
OACCABsing1.43Å1.45Å
OATCASdoub1.22Å1.24Å
NALCAMdoub1.31Å1.33ÅAromatic
CADCAIdoub1.39Å1.39ÅAromatic
CAPCAOsing1.54Å1.56Å
CAPNARsing1.47Å1.50Å
CAPCAQsing1.54Å1.58Å
CAACABsing1.53Å1.55Å
CAGCAJsing1.48Å1.35Å
CAGCAHdoub1.40Å1.40ÅAromatic
CAJNBEsing1.37Å1.32ÅAromatic
CASNARsing1.35Å1.37Å
CASCAUsing1.48Å1.41Å
CAOCANsing1.54Å1.54Å
CAMNBEsing1.36Å1.33ÅAromatic
CAMCANsing1.51Å1.55Å
CAICAHsing1.38Å1.40ÅAromatic
CAQCANsing1.54Å1.55Å
CBDCAUdoub1.39Å1.41ÅAromatic
CBDCBCsing1.39Å1.40ÅAromatic
NBECBFsing1.40Å1.32Å
CAUCAVsing1.42Å1.38ÅAromatic
CBCNBBdoub1.31Å1.38ÅAromatic
CBGCBFdoub1.39Å1.38ÅAromatic
CBGCBHsing1.38Å1.39ÅAromatic
CAVNAWdoub1.33Å1.33ÅAromatic
CAVCBAsing1.42Å1.41ÅAromatic
CBFCBKsing1.39Å1.40ÅAromatic
NAWCAXsing1.31Å1.38ÅAromatic
NBBCBAsing1.33Å1.34ÅAromatic
CBACAZdoub1.41Å1.40ÅAromatic
CAXCAYdoub1.39Å1.40ÅAromatic
CBHCBIdoub1.38Å1.39ÅAromatic
CAZCAYsing1.37Å1.39ÅAromatic
CBKCBJdoub1.38Å1.37ÅAromatic
CBICBJsing1.38Å1.40ÅAromatic
CAAHABsing1.09Å1.10Å
CAAHACsing1.09Å1.10Å
CAAHAAsing1.09Å1.10Å
CABHAEsing1.09Å1.10Å
CABHADsing1.09Å1.10Å
CAEHAFsing1.08Å1.08Å
CAIHAIsing1.08Å1.08Å
CAHHAHsing1.08Å1.08Å
CBGHBGsing1.08Å1.08Å
CBHHBHsing1.08Å1.08Å
CBIHBIsing1.08Å1.08Å
CBJHBJsing1.08Å1.08Å
CBKHBKsing1.08Å1.08Å
CANHANsing1.09Å1.10Å
CAQHASsing1.09Å1.10Å
CAQHARsing1.09Å1.10Å
CAOHAPsing1.09Å1.10Å
CAOHAOsing1.09Å1.10Å
CAPHAQsing1.09Å1.10Å
NARHBLsing0.97Å1.00Å
CAXHAXsing1.08Å1.08Å
CAYHAYsing1.08Å1.08Å
CAZHAZsing1.08Å1.08Å
CBCHBCsing1.08Å1.08Å
CBDHBDsing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
NAFCAECAD121.6°120.8°
CAENAFCAG121.1°121.6°
NAFCAEHAF119.2°119.6°
CAECADOAC114.7°120.3°
CAECADCAI118.7°119.3°
CADCAEHAF119.2°119.6°
NAFCAGCAJ115.6°119.7°
NAFCAGCAH118.5°120.7°
NALNAKCAJ109.8°109.7°
NAKNALCAM106.8°110.1°
NAKCAJCAG124.6°126.5°
NAKCAJNBE108.0°107.0°
CADOACCAB123.5°117.0°
OACCADCAI126.6°120.4°
OACCABCAA107.5°109.5°
OACCABHAE110.0°109.5°
OACCABHAD110.0°109.5°
OATCASNAR124.0°120.1°
OATCASCAU117.4°119.9°
NALCAMNBE109.5°107.4°
NALCAMCAN125.3°126.3°
CADCAICAH118.7°118.5°
CADCAIHAI120.6°120.8°
CAOCAPNAR112.3°113.6°
CAOCAPCAQ89.3°87.1°
CAPCAOCAN90.3°87.0°
CAPCAOHAP114.0°113.7°
CAPCAOHAO114.0°113.7°
CAOCAPHAQ112.2°113.6°
NARCAPCAQ116.1°113.5°
CAPNARCAS123.4°119.9°
NARCAPHAQ113.0°112.8°
CAPNARHBL118.3°120.0°
CAPCAQCAN89.0°87.1°
CAPCAQHAS114.3°113.6°
CAPCAQHAR114.3°113.7°
CAQCAPHAQ111.9°113.8°
CABCAAHAB109.5°109.5°
CABCAAHAC109.5°109.5°
CABCAAHAA109.5°109.5°
CAACABHAE110.0°109.5°
CAACABHAD110.0°109.4°
CAJCAGCAH125.9°119.6°
CAGCAJNBE127.1°126.5°
CAGCAHCAI121.4°119.1°
CAGCAHHAH119.3°120.4°
CAJNBECAM105.7°105.8°
CAJNBECBF125.5°127.2°
NARCASCAU118.5°120.0°
CASNARHBL118.3°120.0°
CASCAUCBD117.7°121.0°
CASCAUCAV125.9°121.1°
CAOCANCAM110.5°113.6°
CAOCANCAQ91.3°87.2°
CAOCANHAN113.5°113.7°
CANCAOHAP114.0°113.6°
CANCAOHAO114.0°113.7°
NBECAMCAN125.1°126.3°
CAMNBECBF128.4°127.1°
CAMCANCAQ113.3°113.6°
CAMCANHAN113.2°112.8°
CAHCAIHAI120.6°120.8°
CAICAHHAH119.3°120.5°
CAQCANHAN113.2°113.7°
CANCAQHAS114.3°113.7°
CANCAQHAR114.3°113.6°
CAUCBDCBC122.3°119.6°
CBDCAUCAV116.4°117.9°
CAUCBDHBD118.9°120.2°
CBDCBCNBB119.5°121.7°
CBDCBCHBC120.2°119.1°
CBCCBDHBD118.9°120.2°
NBECBFCBG122.0°120.1°
NBECBFCBK116.9°120.1°
CAUCAVNAW119.1°121.1°
CAUCAVCBA120.5°118.6°
CBCNBBCBA119.2°121.8°
NBBCBCHBC120.3°119.1°
CBFCBGCBH118.4°119.9°
CBGCBFCBK121.1°119.9°
CBFCBGHBG120.8°120.1°
CBGCBHCBI120.7°120.1°
CBHCBGHBG120.8°120.0°
CBGCBHHBH119.6°119.9°
NAWCAVCBA120.4°120.3°
CAVNAWCAX120.1°121.3°
CAVCBANBB122.2°120.4°
CAVCBACAZ120.6°118.6°
CBFCBKCBJ120.5°119.9°
CBFCBKHBK119.7°120.0°
NAWCAXCAY121.2°121.6°
NAWCAXHAX119.4°119.2°
NBBCBACAZ117.2°121.0°
CBACAZCAY118.2°118.2°
CBACAZHAZ120.9°120.9°
CAXCAYCAZ119.4°120.0°
CAYCAXHAX119.4°119.2°
CAXCAYHAY120.3°120.0°
CBHCBICBJ120.7°120.1°
CBICBHHBH119.6°120.0°
CBHCBIHBI119.6°120.0°
CAZCAYHAY120.3°120.0°
CAYCAZHAZ120.9°120.9°
CBKCBJCBI118.5°120.1°
CBKCBJHBJ120.8°120.0°
CBJCBKHBK119.8°120.1°
CBJCBIHBI119.6°119.9°
CBICBJHBJ120.7°119.9°
HABCAAHAC109.5°109.5°
HABCAAHAA109.4°109.4°
HACCAAHAA109.5°109.4°
HAECABHAD109.5°109.5°
HASCAQHAR109.5°112.8°
HAPCAOHAO109.5°112.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NAFCAECADHAF180.0°179.9°
NAFCAECADOAC179.0°180.0°
NAFCAECADCAI0.0°0.3°
CAENAFCAGCAJ177.5°180.0°
CAENAFCAGCAH2.5°0.4°
CADCAENAFCAG2.0°0.0°
CAECADOACCAI178.9°179.6°
CAECADOACCAB171.8°0.3°
CAECADCAICAH1.2°0.4°
CAECADCAIHAI178.8°179.7°
NAFCAGCAJNAK95.6°179.6°
NAFCAGCAJCAH180.0°179.6°
NAFCAGCAJNBE77.9°0.1°
NAFCAGCAHCAI1.3°0.3°
CAGNAFCAEHAF178.0°179.9°
NAFCAGCAHHAH178.7°179.7°
NALNAKCAJCAG178.1°180.0°
NALNAKCAJNBE3.6°0.3°
NAKNALCAMNBE1.4°0.0°
NAKNALCAMCAN178.0°180.0°
CAJNAKNALCAM1.3°0.2°
NAKCAJCAGNBE173.5°179.7°
NAKCAJCAGCAH84.5°0.0°
NAKCAJNBECAM4.3°0.3°
NAKCAJNBECBF177.6°179.7°
CADOACCABCAA166.6°180.0°
OACCADCAICAH179.9°180.0°
CADOACCABHAE46.9°60.0°
CADOACCABHAD73.7°60.0°
OACCADCAEHAF1.0°0.1°
OACCADCAIHAI0.1°0.1°
CABOACCADCAI7.1°180.0°
OACCABCAAHAE119.7°120.0°
OACCABCAAHAD119.7°120.0°
OACCABCAAHAB180.0°60.0°
OACCABCAAHAC60.0°180.0°
OACCABCAAHAA60.0°60.0°
OACCABHAEHAD120.9°120.0°
OATCASNARCAP3.8°0.0°
OATCASNARCAU175.9°179.9°
OATCASCAUCBD3.4°179.7°
OATCASCAUCAV176.3°0.1°
OATCASNARHBL176.2°180.0°
NALCAMNBECAJ3.6°0.2°
NALCAMCANCAO94.8°39.1°
NALCAMNBECAN176.6°180.0°
NALCAMCANCAQ6.1°58.4°
NALCAMNBECBF176.7°179.8°
NALCAMCANHAN136.7°170.4°
CADCAICAHCAG0.6°0.0°
CADCAICAHHAI180.0°179.9°
CAICADCAEHAF180.0°179.7°
CADCAICAHHAH179.4°180.0°
CAOCAPNARCAQ100.7°97.5°
CAOCAPNARHAQ128.1°131.2°
CAOCAPCAQHAQ113.7°114.6°
CAOCAPNARCAS174.1°155.0°
CAPCAOCANHAP116.6°114.6°
CAPCAOCANHAO116.6°114.6°
CAPCAOCANCAM118.1°139.9°
CAOCAPCAQCAN2.5°25.4°
CAPCAOCANHAN113.5°89.3°
CAOCAPCAQHAS118.9°89.2°
CAOCAPCAQHAR113.9°139.9°
CAPCAOHAPHAO129.1°131.3°
CAOCAPNARHBL5.8°25.0°
NARCAPCAQHAQ131.7°130.9°
CAPNARCASHBL180.0°180.0°
CAPNARCASCAU179.7°179.9°
NARCAPCAOCAN115.5°89.1°
NARCAPCAQCAN112.1°89.1°
NARCAPCAQHAS4.3°156.3°
NARCAPCAQHAR131.5°25.4°
NARCAPCAOHAP127.9°25.4°
NARCAPCAOHAO1.2°156.3°
CAQCAPNARCAS73.4°107.5°
CAPCAQCANCAM115.6°140.0°
CAPCAQCANHAS116.4°114.5°
CAPCAQCANHAR116.3°114.6°
CAPCAQCANHAN113.8°89.2°
CAPCAQHASHAR129.7°131.3°
CAQCAPCAOHAP114.1°139.9°
CAQCAPCAOHAO119.2°89.2°
CAQCAPNARHBL106.5°72.5°
CABCAAHABHAC120.0°120.1°
CABCAAHABHAA120.0°120.0°
CABCAAHACHAA120.0°120.0°
CAACABHAEHAD120.9°120.0°
CAGCAJNBECAM178.6°180.0°
CAJCAGCAHCAI178.8°180.0°
CAGCAJNBECBF8.0°0.0°
CAJCAGCAHHAH1.2°0.0°
CAHCAGCAJNBE102.1°179.7°
CAGCAHCAIHAH180.0°180.0°
CAGCAHCAIHAI179.4°180.0°
CAJNBECAMCBF173.1°180.0°
CAJNBECAMCAN179.8°179.8°
CAJNBECBFCBG118.1°114.7°
CAJNBECBFCBK64.6°65.0°
NARCASCAUCBD179.5°0.2°
NARCASCAUCAV0.2°180.0°
CASNARCAPHAQ57.8°23.8°
CASCAUCBDCAV179.7°179.8°
CASCAUCBDCBC178.1°179.7°
CASCAUCAVNAW2.2°0.1°
CASCAUCAVCBA178.6°180.0°
CAUCASNARHBL0.3°0.1°
CASCAUCBDHBD1.9°0.0°
CAOCANCAMNBE81.3°140.9°
CAOCANCAMCAQ100.8°97.6°
CAOCANCAMHAN128.5°131.2°
CAOCANCAQHAN116.3°114.6°
CAOCANCAQHAS118.9°89.1°
CAOCANCAQHAR113.8°140.1°
CANCAOHAPHAO129.1°131.2°
CANCAOCAPHAQ115.9°140.1°
NBECAMCANCAQ177.9°121.6°
CAMNBECBFCBG70.1°65.3°
CAMNBECBFCBK107.2°115.0°
NBECAMCANHAN47.2°9.6°
CAMCANCAQHAN130.7°130.8°
CANCAMNBECBF6.7°0.2°
CAMCANCAQHAS128.0°25.4°
CAMCANCAQHAR0.8°105.4°
CAMCANCAOHAP1.5°105.5°
CAMCANCAOHAO125.3°25.3°
CANCAQHASHAR129.7°131.2°
CAQCANCAOHAP114.0°140.0°
CAQCANCAOHAO119.2°89.2°
CANCAQCAPHAQ116.2°140.0°
CAUCBDCBCHBD180.0°179.7°
CAUCBDCBCNBB0.5°0.6°
CBDCAUCAVNAW178.1°179.7°
CBDCAUCAVCBA1.2°0.3°
CAUCBDCBCHBC179.5°179.7°
CBCCBDCAUCAV1.6°0.5°
CBDCBCNBBHBC180.0°179.7°
CBDCBCNBBCBA1.2°0.3°
NBECBFCBGCBK177.2°179.7°
NBECBFCBGCBH179.2°180.0°
NBECBFCBKCBJ179.0°179.7°
NBECBFCBGHBG0.8°0.0°
NBECBFCBKHBK1.0°0.1°
CAUCAVNAWCBA179.2°180.0°
CAUCAVNAWCAX178.8°180.0°
CAUCAVCBANBB0.5°0.0°
CAUCAVCBACAZ180.0°180.0°
CAVCAUCBDHBD178.4°179.8°
CBCNBBCBACAV1.7°0.0°
CBCNBBCBACAZ178.7°180.0°
NBBCBCCBDHBD179.5°179.7°
CBFCBGCBHHBG180.0°180.0°
CBFCBGCBHCBI0.6°0.0°
CBGCBFCBKCBJ1.7°0.6°
CBFCBGCBHHBH179.4°179.9°
CBGCBFCBKHBK178.3°179.8°
CBHCBGCBFCBK2.1°0.3°
CBGCBHCBIHBH180.0°180.0°
CBGCBHCBICBJ1.3°0.0°
CBGCBHCBIHBI178.7°180.0°
NAWCAVCBANBB179.7°180.0°
NAWCAVCBACAZ0.7°0.0°
CAVNAWCAXCAY1.6°0.0°
CAVNAWCAXHAX178.4°180.0°
CBACAVNAWCAX2.0°0.0°
CAVCBANBBCAZ179.6°180.0°
CAVCBACAZCAY0.9°0.0°
CAVCBACAZHAZ179.1°180.0°
CBFCBKCBJHBK180.0°179.7°
CBFCBKCBJCBI0.3°0.6°
CBKCBFCBGHBG177.9°179.7°
CBFCBKCBJHBJ179.7°179.7°
NAWCAXCAYHAX180.0°180.0°
NAWCAXCAYCAZ0.0°0.0°
NAWCAXCAYHAY180.0°180.0°
NBBCBACAZCAY178.7°180.0°
NBBCBACAZHAZ1.3°0.1°
CBANBBCBCHBC178.8°180.0°
CBACAZCAYCAX1.2°0.0°
CBACAZCAYHAZ180.0°180.0°
CBACAZCAYHAY178.8°180.0°
CAXCAYCAZHAY180.0°179.9°
CAXCAYCAZHAZ178.8°180.0°
CBHCBICBJCBK1.7°0.3°
CBHCBICBJHBI180.0°180.0°
CBICBHCBGHBG179.4°180.0°
CBHCBICBJHBJ178.3°180.0°
CAZCAYCAXHAX180.0°180.0°
CBKCBJCBIHBJ180.0°179.8°
CBKCBJCBIHBI178.3°179.7°
CBJCBICBHHBH178.7°180.0°
CBICBJCBKHBK179.7°179.7°
HABCAAHACHAA120.0°119.9°
HABCAACABHAE60.3°180.0°
HABCAACABHAD60.3°60.0°
HACCAACABHAE179.7°60.0°
HACCAACABHAD59.7°60.0°
HAACAACABHAE59.7°60.0°
HAACAACABHAD179.7°180.0°
HAICAICAHHAH0.6°0.0°
HBGCBGCBHHBH0.6°0.0°
HBHCBHCBIHBI1.3°0.0°
HBICBICBJHBJ1.7°0.1°
HBJCBJCBKHBK0.3°0.0°
HANCANCAQHAS2.6°156.2°
HANCANCAQHAR129.9°25.4°
HANCANCAOHAP129.9°25.3°
HANCANCAOHAO3.2°156.1°
HASCAQCAPHAQ127.5°25.4°
HARCAQCAPHAQ0.2°105.4°
HAPCAOCAPHAQ0.7°105.4°
HAOCAOCAPHAQ127.4°25.5°
HAQCAPNARHBL122.3°156.2°
HAXCAXCAYHAY0.0°0.1°
HAYCAYCAZHAZ1.2°0.0°
HBCCBCCBDHBD0.5°0.0°

226262

PDB entries from 2024-10-16

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