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H3X

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAKCALsing1.51Å1.55Å
CAKCAJsing1.53Å1.54Å
CAQCALsing1.53Å1.54Å
CALCAGsing1.52Å1.54Å
CAJCACsing1.52Å1.51Å
CATCABsing1.54Å1.54Å
CAHOANsing1.45Å1.43Å
CACCABsing1.53Å1.62Å
CACCADsing1.52Å1.59Å
OANCAPsing1.34Å1.37Å
CAMCBFsing1.51Å1.40Å
CABCASsing1.53Å1.53Å
CABOAWsing1.43Å1.42Å
CAGOBEsing1.45Å1.47Å
CAGCADsing1.54Å1.56Å
CAGCBCsing1.54Å1.57Å
OBECBDsing1.33Å1.35Å
CBFCBDdoub1.35Å1.33Å
CBFCAZsing1.41Å1.39Å
CBDCAOsing1.51Å1.41Å
CADCAEsing1.51Å1.55Å
CADCARsing1.52Å1.54Å
OBACAZdoub1.22Å1.23Å
CAACAEsing1.52Å1.55Å
CAACAVsing1.47Å1.40Å
CBCCAOsing1.53Å1.57Å
CAZCBBsing1.51Å1.41Å
CAICAOsing1.53Å1.53Å
CAICBBsing1.53Å1.55Å
CAICAUsing1.53Å1.55Å
CAPCBBsing1.51Å1.41Å
CAPOAYdoub1.21Å1.23Å
OAWCAVsing1.31Å1.35Å
CAOCAFsing1.54Å1.55Å
CAVOAXdoub1.23Å1.24Å
CAAH1sing1.09Å1.10Å
CAAH2sing1.11Å1.10Å
CACH3sing1.11Å1.10Å
CAEH4sing1.10Å1.10Å
CAEH5sing1.10Å1.10Å
CAFH6sing1.09Å1.10Å
CAFH7sing1.09Å1.10Å
CAFH8sing1.09Å1.10Å
CAHH9sing1.09Å1.10Å
CAHH10sing1.09Å1.10Å
CAHH11sing1.09Å1.10Å
CAIH12sing1.09Å1.10Å
CAJH13sing1.08Å1.10Å
CAJH14sing1.11Å1.10Å
CAKH15sing1.10Å1.10Å
CAKH16sing1.10Å1.10Å
CALH17sing1.13Å1.10Å
CAMH18sing1.09Å1.10Å
CAMH19sing1.09Å1.10Å
CAMH20sing1.09Å1.10Å
CAQH21sing1.09Å1.10Å
CAQH22sing1.09Å1.10Å
CAQH23sing1.09Å1.10Å
CARH24sing1.09Å1.10Å
CARH25sing1.09Å1.10Å
CARH26sing1.09Å1.10Å
CASH27sing1.09Å1.10Å
CASH28sing1.09Å1.10Å
CASH29sing1.09Å1.10Å
CATH30sing1.09Å1.10Å
CATH31sing1.09Å1.10Å
CATH32sing1.09Å1.10Å
CAUH33sing1.09Å1.10Å
CAUH34sing1.09Å1.10Å
CAUH35sing1.09Å1.10Å
CBBH36sing1.09Å1.10Å
CBCH37sing1.09Å1.10Å
CBCH38sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CALCAKCAJ113.4°115.6°
CAKCALCAQ108.3°111.7°
CAKCALCAG109.0°116.9°
CALCAKH15108.5°109.2°
CALCAKH16108.5°109.4°
CAKCALH17108.8°105.2°
CAKCAJCAC108.5°110.2°
CAKCAJH13109.7°111.3°
CAKCAJH14109.7°104.5°
CAJCAKH15108.5°107.9°
CAJCAKH16108.5°108.2°
CAQCALCAG112.7°112.9°
CAQCALH17108.9°104.0°
CALCAQH21109.5°109.5°
CALCAQH22109.4°109.4°
CALCAQH23109.4°109.5°
CALCAGOBE111.3°109.1°
CALCAGCAD108.1°115.2°
CALCAGCBC110.4°107.4°
CAGCALH17108.9°104.7°
CAJCACCAB110.0°115.2°
CAJCACCAD111.4°112.9°
CAJCACH3105.8°103.0°
CACCAJH13109.7°114.0°
CACCAJH14109.7°110.4°
CATCABCAC107.6°108.3°
CATCABCAS107.2°107.1°
CATCABOAW110.2°108.8°
CABCATH30109.5°109.5°
CABCATH31109.5°109.5°
CABCATH32109.5°109.5°
CAHOANCAP111.0°117.0°
OANCAHH9109.5°109.5°
OANCAHH10109.5°109.5°
OANCAHH11109.5°109.5°
CABCACCAD118.8°118.0°
CACCABCAS111.9°111.5°
CACCABOAW114.0°112.3°
CABCACH3104.7°102.6°
CACCADCAG110.4°111.5°
CACCADCAE106.8°124.9°
CACCADCAR114.1°101.5°
CADCACH3105.0°102.2°
OANCAPCBB115.0°120.0°
OANCAPOAY123.3°120.0°
CAMCBFCBD118.6°120.3°
CAMCBFCAZ119.0°120.7°
CBFCAMH18109.5°109.5°
CBFCAMH19109.5°109.5°
CBFCAMH20109.5°109.4°
CASCABOAW105.9°108.7°
CABCASH27109.5°109.5°
CABCASH28109.5°109.5°
CABCASH29109.5°109.5°
CABOAWCAV121.0°125.3°
OBECAGCAD108.8°110.3°
OBECAGCBC104.2°106.1°
CAGOBECBD108.9°110.6°
CADCAGCBC114.0°108.4°
CAGCADCAE108.6°114.6°
CAGCADCAR105.6°99.9°
CAGCBCCAO103.7°104.2°
CAGCBCH37110.9°109.9°
CAGCBCH38110.9°109.8°
OBECBDCBF125.9°126.5°
OBECBDCAO113.0°109.4°
CBDCBFCAZ122.4°118.9°
CBFCBDCAO121.0°124.1°
CBFCAZOBA118.7°119.6°
CBFCAZCBB120.4°120.8°
CBDCAOCBC104.0°104.4°
CBDCAOCAI110.2°106.7°
CBDCAOCAF109.8°111.7°
CAECADCAR111.2°98.8°
CADCAECAA112.7°118.6°
CADCAEH4108.7°107.9°
CADCAEH5108.6°107.0°
CADCARH24109.5°109.4°
CADCARH25109.5°109.4°
CADCARH26109.5°109.4°
OBACAZCBB120.9°119.6°
CAECAACAV110.9°113.5°
CAECAAH1109.1°111.6°
CAECAAH2109.1°108.2°
CAACAEH4108.7°109.1°
CAACAEH5108.7°107.9°
CAACAVOAW127.4°131.6°
CAACAVOAX120.5°114.2°
CAVCAAH1109.1°110.3°
CAVCAAH2109.1°107.7°
CBCCAOCAI116.3°111.4°
CBCCAOCAF108.3°111.2°
CAOCBCH37110.9°111.6°
CAOCBCH38110.9°110.9°
CAZCBBCAI110.6°112.1°
CAZCBBCAP108.6°108.7°
CAZCBBH36110.3°109.4°
CAOCAICBB107.5°109.2°
CAOCAICAU111.7°109.6°
CAICAOCAF108.2°111.2°
CAOCAIH12109.4°109.5°
CBBCAICAU109.9°109.4°
CAICBBCAP108.5°108.7°
CBBCAIH12109.1°109.7°
CAICBBH36108.4°109.7°
CAUCAIH12109.1°109.4°
CAICAUH33109.5°109.5°
CAICAUH34109.5°109.4°
CAICAUH35109.5°109.5°
CBBCAPOAY121.7°120.0°
CAPCBBH36110.4°108.1°
OAWCAVOAX112.0°114.2°
CAOCAFH6109.5°109.5°
CAOCAFH7109.5°109.5°
CAOCAFH8109.5°109.5°
H1CAAH2109.4°105.0°
H4CAEH5109.5°105.7°
H6CAFH7109.5°109.4°
H6CAFH8109.4°109.5°
H7CAFH8109.5°109.4°
H9CAHH10109.5°109.5°
H9CAHH11109.5°109.4°
H10CAHH11109.4°109.5°
H13CAJH14109.5°105.9°
H15CAKH16109.5°106.2°
H18CAMH19109.5°109.5°
H18CAMH20109.5°109.5°
H19CAMH20109.4°109.4°
H21CAQH22109.5°109.5°
H21CAQH23109.5°109.5°
H22CAQH23109.5°109.5°
H24CARH25109.5°109.5°
H24CARH26109.4°109.5°
H25CARH26109.5°109.5°
H27CASH28109.4°109.4°
H27CASH29109.4°109.5°
H28CASH29109.5°109.5°
H30CATH31109.4°109.5°
H30CATH32109.5°109.5°
H31CATH32109.4°109.4°
H33CAUH34109.4°109.5°
H33CAUH35109.5°109.5°
H34CAUH35109.5°109.5°
H37CBCH38109.5°110.3°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CALCAKCAJH15120.6°122.5°
CALCAKCAJH16120.6°123.0°
CAKCALCAQCAG120.7°134.2°
CAKCALCAQH17118.2°112.9°
CAKCALCAGH17118.6°115.9°
CALCAKCAJCAC30.8°47.5°
CAKCALCAGOBE50.3°159.4°
CAKCALCAGCAD69.1°34.8°
CAKCALCAGCBC165.5°86.0°
CALCAKCAJH13150.6°80.0°
CALCAKCAJH1489.1°166.1°
CALCAKH15H16118.2°117.8°
CAKCALCAQH21180.0°66.2°
CAKCALCAQH2260.0°173.8°
CAKCALCAQH2360.0°53.8°
CAJCAKCALCAQ157.6°95.1°
CAJCAKCALCAG34.6°37.1°
CAKCAJCACH13119.8°126.0°
CAKCAJCACH14119.8°114.9°
CAKCAJCACCAB160.5°162.3°
CAKCAJCACCAD65.6°57.9°
CAKCAJCACH348.0°51.5°
CAKCAJH13H14120.5°113.1°
CAJCAKH15H16118.2°115.8°
CAJCAKCALH1784.1°152.7°
CAQCALCAGH17121.0°112.4°
CAQCALCAGOBE70.1°27.7°
CAQCALCAGCAD170.6°96.9°
CAQCALCAGCBC45.2°142.3°
CAQCALCAKH1581.8°26.8°
CAQCALCAKH1637.0°142.6°
CALCAQH21H22120.0°120.0°
CALCAQH21H23120.0°120.0°
CALCAQH22H23120.0°120.0°
CALCAGCADCAC34.6°43.5°
CALCAGOBECAD118.9°127.4°
CALCAGOBECBC119.1°115.4°
CALCAGCADCBC123.2°120.3°
CALCAGOBECBD101.6°98.1°
CALCAGCADCAE82.2°167.6°
CALCAGCADCAR158.5°63.0°
CALCAGCBCCAO116.3°113.3°
CAGCALCAKH15155.2°159.0°
CAGCALCAKH1686.0°85.2°
CAGCALCAQH2159.2°159.5°
CAGCALCAQH2260.8°39.5°
CAGCALCAQH23179.3°80.4°
CALCAGCBCH372.8°6.3°
CALCAGCBCH38124.6°127.8°
CAJCACCABCAT79.3°145.3°
CAJCACCABCAD130.1°137.6°
CAJCACCABH3113.2°111.0°
CAJCACCADH3114.1°109.9°
CAJCACCABCAS38.2°27.7°
CAJCACCABOAW158.2°94.6°
CAJCACCADCAG30.9°56.3°
CAJCACCADCAE148.9°158.7°
CAJCACCADCAR87.8°49.3°
CACCAJH13H14120.5°121.5°
CACCAJCAKH1589.8°170.0°
CACCAJCAKH16151.4°75.5°
CATCABCACCAS117.4°117.5°
CATCABCACOAW122.5°120.1°
CATCABCACCAD150.7°77.1°
CATCABCASOAW117.6°117.3°
CATCABOAWCAV85.6°45.1°
CATCABCACH334.0°34.2°
CATCABCASH27180.0°57.3°
CATCABCASH2860.0°62.7°
CATCABCASH2960.0°177.3°
CABCATH30H31120.0°120.1°
CABCATH30H32120.0°120.0°
CABCATH31H32120.0°120.0°
CAHOANCAPCBB167.0°180.0°
CAHOANCAPOAY14.5°0.0°
OANCAHH9H10120.0°120.0°
OANCAHH9H11120.0°120.0°
OANCAHH10H11120.0°120.0°
CABCACCADH3116.6°111.5°
CACCABCASOAW124.7°124.4°
CABCACCADCAG160.3°165.1°
CABCACCADCAE81.8°20.2°
CABCACCADCAR41.5°89.3°
CACCABOAWCAV35.4°74.7°
CABCACCAJH1340.7°71.7°
CABCACCAJH1479.6°47.4°
CACCABCASH2762.3°175.6°
CACCABCASH28177.7°55.6°
CACCABCASH2957.7°64.4°
CACCABCATH30180.0°179.7°
CACCABCATH3160.0°59.6°
CACCABCATH3260.0°60.3°
CADCACCABCAS91.9°165.4°
CADCACCABOAW28.2°43.0°
CACCADCAGOBE86.3°167.5°
CACCADCAGCAE116.8°148.8°
CACCADCAGCAR123.8°106.6°
CACCADCAGCBC157.8°76.7°
CACCADCAECAR125.1°110.7°
CACCADCAECAA28.4°66.5°
CACCADCAEH4148.9°58.1°
CACCADCAEH592.0°171.4°
CADCACCAJH13174.6°68.1°
CADCACCAJH1454.3°172.8°
CACCADCARH24180.0°59.4°
CACCADCARH2560.0°179.4°
CACCADCARH2660.0°60.6°
OANCAPCBBCAZ56.8°57.7°
OANCAPCBBCAI63.4°180.0°
OANCAPCBBOAY178.6°180.0°
CAPOANCAHH9180.0°60.0°
CAPOANCAHH1060.0°60.0°
CAPOANCAHH1160.0°180.0°
OANCAPCBBH36177.9°60.9°
CAMCBFCBDOBE0.5°8.2°
CAMCBFCBDCAZ178.7°178.5°
CAMCBFCBDCAO177.5°175.5°
CAMCBFCAZOBA1.1°5.1°
CAMCBFCAZCBB178.7°174.8°
CBFCAMH18H19120.0°120.1°
CBFCAMH18H20120.0°120.0°
CBFCAMH19H20120.0°120.0°
CASCABOAWCAV158.8°161.4°
CASCABCACH3151.4°83.3°
CABCASH27H28120.0°120.0°
CABCASH27H29120.0°120.0°
CABCASH28H29120.0°120.0°
CASCABCATH3059.6°60.0°
CASCABCATH31179.6°180.0°
CASCABCATH3260.5°60.0°
CABOAWCAVCAA3.2°56.1°
CABOAWCAVOAX179.0°124.1°
OAWCABCACH388.5°154.3°
OAWCABCASH2762.4°60.0°
OAWCABCASH2857.6°180.0°
OAWCABCASH29177.6°60.0°
OAWCABCATH3055.2°57.4°
OAWCABCATH3164.8°62.7°
OAWCABCATH32175.2°177.4°
OBECAGCADCBC115.8°115.8°
CAGOBECBDCBF155.7°152.2°
CAGOBECBDCAO27.2°24.6°
OBECAGCADCAE156.8°43.7°
OBECAGCADCAR37.5°60.9°
OBECAGCBCCAO3.3°3.2°
OBECAGCALH17168.9°84.7°
OBECAGCBCH37122.4°122.8°
OBECAGCBCH38115.8°115.7°
CADCAGOBECBD139.5°134.5°
CAGCADCAECAR115.8°105.2°
CAGCADCAECAA147.5°149.5°
CADCAGCBCCAO121.8°121.6°
CAGCADCACH383.1°53.6°
CAGCADCAEH492.0°85.9°
CAGCADCAEH527.1°27.4°
CADCAGCALH1749.5°150.7°
CAGCADCARH2458.5°55.1°
CAGCADCARH25178.5°64.9°
CAGCADCARH2661.5°175.1°
CADCAGCBCH37119.1°118.8°
CADCAGCBCH382.7°2.8°
CBCCAGOBECBD17.5°17.3°
CAGCBCCAOCBD10.9°9.9°
CBCCAGCADCAE41.0°72.1°
CBCCAGCADCAR78.3°176.7°
CAGCBCCAOH37119.1°118.5°
CAGCBCCAOH38119.1°118.1°
CAGCBCCAOCAI132.2°124.6°
CAGCBCCAOCAF105.9°110.7°
CBCCAGCALH1775.8°29.9°
CAGCBCH37H38122.7°121.2°
OBECBDCBFCAO176.9°176.3°
OBECBDCBFCAZ179.3°170.4°
OBECBDCAOCBC23.7°21.3°
OBECBDCAOCAI148.9°139.4°
OBECBDCAOCAF92.0°98.9°
CBDCBFCAZOBA179.8°176.4°
CBFCBDCAOCBC159.0°155.5°
CBDCBFCAZCBB0.0°3.7°
CBFCBDCAOCAI33.8°37.4°
CBFCBDCAOCAF85.3°84.3°
CBDCBFCAMH18180.0°90.0°
CBDCBFCAMH1960.0°149.9°
CBDCBFCAMH2060.0°30.0°
CAZCBFCBDCAO3.8°5.9°
CBFCAZOBACBB179.9°180.0°
CBFCAZCBBCAI26.3°20.5°
CBFCAZCBBCAP145.3°140.7°
CAZCBFCAMH181.2°88.5°
CAZCBFCAMH19121.2°31.6°
CAZCBFCAMH20118.8°151.5°
CBFCAZCBBH3693.6°101.4°
CBDCAOCBCCAI121.3°114.7°
CBDCAOCBCCAF116.8°120.6°
CBDCAOCAICAF120.1°122.0°
CBDCAOCAICBB57.1°58.2°
CBDCAOCAICAU177.8°178.0°
CBDCAOCAFH6180.0°179.8°
CBDCAOCAFH760.0°60.2°
CBDCAOCAFH860.0°59.8°
CBDCAOCAIH1261.3°62.0°
CBDCAOCBCH37108.1°108.6°
CBDCAOCBCH38130.0°128.0°
CADCAECAAH4120.5°124.0°
CADCAECAAH5120.5°121.7°
CADCAECAACAV55.7°50.0°
CADCAECAAH1176.0°75.4°
CADCAECAAH264.5°169.5°
CAECADCACH334.8°91.4°
CADCAEH4H5118.5°114.2°
CAECADCARH2459.1°172.1°
CAECADCARH2560.9°52.1°
CAECADCARH26179.1°67.9°
CARCADCAECAA96.7°44.2°
CARCADCACH3158.1°159.2°
CARCADCAEH423.8°168.8°
CARCADCAEH5142.8°77.9°
CADCARH24H25120.0°119.9°
CADCARH24H26120.0°119.9°
CADCARH25H26120.0°120.0°
OBACAZCBBCAI153.6°159.4°
OBACAZCBBCAP34.6°39.2°
OBACAZCBBH3686.5°78.6°
CAECAACAVH1120.2°126.1°
CAECAACAVH2120.2°119.8°
CAECAACAVOAW77.1°33.7°
CAECAACAVOAX98.3°146.6°
CAECAAH1H2119.3°117.0°
CAACAEH4H5118.5°115.7°
CAACAVOAWOAX175.8°179.8°
CAVCAAH1H2119.4°115.8°
CAVCAACAEH464.7°74.0°
CAVCAACAEH5176.2°171.7°
CBCCAOCAICAF122.0°124.7°
CBCCAOCAICBB175.0°171.5°
CBCCAOCAICAU64.3°68.6°
CBCCAOCAFH667.1°64.1°
CBCCAOCAFH752.9°55.9°
CBCCAOCAFH8172.9°175.9°
CBCCAOCAIH1256.6°51.4°
CAOCBCH37H38122.7°123.8°
CAZCBBCAICAO53.5°52.1°
CAZCBBCAICAP119.0°120.2°
CAZCBBCAIH36121.0°121.8°
CAZCBBCAICAU175.3°172.0°
CAZCBBCAPH36121.0°118.6°
CAZCBBCAPOAY124.6°122.3°
CAZCBBCAIH1265.1°68.0°
CAOCAICBBCAU121.8°120.0°
CAOCAICBBH12118.6°120.1°
CAOCAICAUH12121.1°120.1°
CAOCAICBBCAP172.5°172.3°
CAICAOCAFH659.7°60.7°
CAICAOCAFH7179.7°179.3°
CAICAOCAFH860.3°59.3°
CAOCAICAUH33180.0°60.1°
CAOCAICAUH3460.0°180.0°
CAOCAICAUH3560.0°60.0°
CAOCAICBBH3667.5°69.7°
CAICAOCBCH3713.1°6.2°
CAICAOCBCH38108.7°117.3°
CBBCAICAUH12119.6°120.2°
CAICBBCAPH36118.7°119.1°
CAICBBCAPOAY115.2°0.0°
CBBCAICAOCAF63.0°63.8°
CBBCAICAUH3360.7°59.7°
CBBCAICAUH34179.3°60.3°
CBBCAICAUH3559.3°179.7°
CAUCAICBBCAP65.7°67.8°
CAUCAICAOCAF57.7°56.0°
CAICAUH33H34120.0°119.9°
CAICAUH33H35120.0°120.0°
CAICAUH34H35120.0°120.0°
CAUCAICBBH3654.3°50.3°
CAPCBBCAIH1253.9°52.2°
OAYCAPCBBH363.6°119.0°
OAWCAVCAAH1162.7°92.5°
OAWCAVCAAH243.1°153.5°
CAOCAFH6H7120.0°120.0°
CAOCAFH6H8120.0°120.1°
CAOCAFH7H8120.0°120.0°
CAFCAOCAIH12178.6°176.0°
CAFCAOCBCH37135.1°130.9°
CAFCAOCBCH3813.2°7.4°
OAXCAVCAAH121.9°87.3°
OAXCAVCAAH2141.4°26.8°
H1CAACAEH455.5°160.6°
H1CAACAEH563.6°46.2°
H2CAACAEH4175.0°45.5°
H2CAACAEH556.0°68.8°
H3CACCAJH1371.8°177.5°
H3CACCAJH14167.9°63.4°
H6CAFH7H8120.0°119.9°
H9CAHH10H11120.0°120.0°
H12CAICAUH3358.8°179.8°
H12CAICAUH3461.1°59.9°
H12CAICAUH35178.8°60.1°
H12CAICBBH36173.9°170.2°
H13CAJCAKH1530.0°42.5°
H13CAJCAKH1688.8°157.1°
H14CAJCAKH15150.4°71.4°
H14CAJCAKH1631.5°43.1°
H15CAKCALH1736.5°85.4°
H16CAKCALH17155.3°30.4°
H17CALCAQH2161.8°46.7°
H17CALCAQH22178.2°73.3°
H17CALCAQH2358.2°166.7°
H18CAMH19H20120.0°120.0°
H21CAQH22H23120.0°120.0°
H24CARH25H26120.0°120.1°
H27CASH28H29120.0°120.0°
H30CATH31H32120.0°120.0°
H33CAUH34H35120.0°120.1°

223790

PDB entries from 2024-08-14

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