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U46

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OAXCAWsing1.34Å1.26Å
OAXHAXsing0.97Å0.95Å
CAWOAYdoub1.21Å1.25Å
CAWCARsing1.51Å1.52Å
CARCAQsing1.53Å1.54Å
CARHAR1sing1.09Å1.10Å
CARHAR2sing1.09Å1.10Å
CAQCAPsing1.53Å1.51Å
CAQHAQ1sing1.09Å1.10Å
CAQHAQ2sing1.09Å1.10Å
CAPCAOsing1.51Å1.50Å
CAPHAP1sing1.09Å1.10Å
CAPHAP2sing1.09Å1.10Å
CAOCANdoub1.31Å1.33Å
CAOHAOsing1.08Å1.08Å
CANCAFsing1.51Å1.51Å
CANHANsing1.08Å1.08Å
CAFCADsing1.53Å1.51Å
CAFHAF1sing1.09Å1.10Å
CAFHAF2sing1.09Å1.10Å
CADCACsing1.56Å1.51Å
CADCAEsing1.55Å1.54Å
CADHADsing1.09Å1.10Å
CACCABsing1.57Å1.50Å
CACCATsing1.56Å1.52Å
CACHACsing1.09Å1.10Å
CABCAAsing1.57Å1.51Å
CABHAB1sing1.09Å1.10Å
CABHAB2sing1.09Å1.10Å
CATOASsing1.46Å1.44Å
CATHAT1sing1.09Å1.10Å
CATHAT2sing1.09Å1.10Å
OASCAAsing1.45Å1.42Å
CAACAEsing1.56Å1.53Å
CAAHAAsing1.09Å1.10Å
CAECAGsing1.51Å1.52Å
CAEHAEsing1.09Å1.10Å
CAGCAHdoub1.31Å1.34Å
CAGHAGsing1.08Å1.08Å
CAHCAIsing1.51Å1.53Å
CAHHAHsing1.08Å1.08Å
CAIOAUsing1.43Å1.44Å
CAICAJsing1.53Å1.54Å
CAIHAIsing1.09Å1.10Å
OAUHAUsing0.97Å0.95Å
CAJCAKsing1.53Å1.53Å
CAJHAJ1sing1.09Å1.10Å
CAJHAJ2sing1.09Å1.10Å
CAKCALsing1.53Å1.53Å
CAKHAK1sing1.09Å1.10Å
CAKHAK2sing1.09Å1.10Å
CALCAMsing1.53Å1.53Å
CALHAL1sing1.09Å1.10Å
CALHAL2sing1.09Å1.10Å
CAMCAVsing1.53Å1.51Å
CAMHAM1sing1.09Å1.10Å
CAMHAM2sing1.09Å1.10Å
CAVHAV1sing1.09Å1.10Å
CAVHAV2sing1.09Å1.10Å
CAVHAV3sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAWOAXHAX109.5°120.0°
OAXCAWOAY123.0°120.0°
OAXCAWCAR117.3°120.0°
OAYCAWCAR119.6°120.0°
CAWCARCAQ119.3°109.5°
CAWCARHAR1104.0°109.5°
CAWCARHAR2106.3°109.5°
CAQCARHAR1104.0°109.4°
CAQCARHAR2106.3°109.5°
CARCAQCAP99.5°109.4°
CARCAQHAQ1115.0°109.4°
CARCAQHAQ2112.9°109.5°
HAR1CARHAR2117.6°109.5°
CAPCAQHAQ1115.0°109.5°
CAPCAQHAQ2112.9°109.5°
CAQCAPCAO100.9°109.5°
CAQCAPHAP1114.2°109.5°
CAQCAPHAP2112.4°109.5°
HAQ1CAQHAQ2102.1°109.5°
CAOCAPHAP1114.2°109.4°
CAOCAPHAP2112.4°109.5°
CAPCAOCAN131.1°120.0°
CAPCAOHAO114.4°120.0°
HAP1CAPHAP2103.1°109.5°
CANCAOHAO114.4°120.0°
CAOCANCAF134.2°120.0°
CAOCANHAN112.9°120.0°
CAFCANHAN112.9°120.0°
CANCAFCAD125.4°109.5°
CANCAFHAF1100.7°109.5°
CANCAFHAF2104.5°109.5°
CADCAFHAF1100.7°109.5°
CADCAFHAF2104.5°109.4°
CAFCADCAC99.6°110.5°
CAFCADCAE111.8°110.8°
CAFCADHAD112.0°110.5°
HAF1CAFHAF2123.0°109.5°
CACCADCAE101.5°103.7°
CACCADHAD120.9°110.6°
CADCACCAB105.4°100.5°
CADCACCAT105.7°103.6°
CADCACHAC111.1°117.3°
CAECADHAD110.3°110.6°
CADCAECAA103.9°104.5°
CADCAECAG116.0°110.4°
CADCAEHAE109.8°110.4°
CABCACCAT97.8°98.8°
CABCACHAC117.7°117.0°
CACCABCAA94.4°94.6°
CACCABHAB1117.8°112.3°
CACCABHAB2114.8°112.3°
CATCACHAC117.4°116.8°
CACCATOAS103.3°105.7°
CACCATHAT1112.9°110.2°
CACCATHAT2111.6°110.2°
CAACABHAB1117.8°112.3°
CAACABHAB2114.8°112.3°
CABCAAOAS101.1°102.1°
CABCAACAE102.5°100.8°
CABCAAHAA117.1°115.9°
HAB1CABHAB298.5°111.9°
OASCATHAT1112.9°110.4°
OASCATHAT2111.6°110.0°
CATOASCAA106.7°107.1°
HAT1CATHAT2104.8°110.3°
OASCAACAE104.5°104.7°
OASCAAHAA115.4°115.7°
CAECAAHAA114.2°115.6°
CAACAECAG111.7°110.5°
CAACAEHAE114.2°110.5°
CAGCAEHAE101.6°110.4°
CAECAGCAH118.9°120.0°
CAECAGHAG120.6°120.0°
CAHCAGHAG120.5°120.0°
CAGCAHCAI126.8°120.0°
CAGCAHHAH116.6°120.0°
CAICAHHAH116.6°120.0°
CAHCAIOAU111.5°109.5°
CAHCAICAJ113.9°109.5°
CAHCAIHAI106.0°109.5°
OAUCAICAJ112.8°109.4°
OAUCAIHAI107.3°109.5°
CAIOAUHAU109.5°106.8°
CAJCAIHAI104.5°109.5°
CAICAJCAK115.6°109.4°
CAICAJHAJ1106.1°109.5°
CAICAJHAJ2107.5°109.4°
CAKCAJHAJ1106.1°109.5°
CAKCAJHAJ2107.5°109.5°
CAJCAKCAL111.1°109.4°
CAJCAKHAK1108.5°109.5°
CAJCAKHAK2108.9°109.5°
HAJ1CAJHAJ2114.3°109.5°
CALCAKHAK1108.5°109.5°
CALCAKHAK2108.9°109.4°
CAKCALCAM110.2°109.4°
CAKCALHAL1109.1°109.5°
CAKCALHAL2109.2°109.4°
HAK1CAKHAK2110.8°109.5°
CAMCALHAL1109.1°109.5°
CAMCALHAL2109.3°109.5°
CALCAMCAV112.0°109.4°
CALCAMHAM1108.1°109.5°
CALCAMHAM2108.7°109.5°
HAL1CALHAL2110.0°109.5°
CAVCAMHAM1108.1°109.5°
CAVCAMHAM2108.6°109.4°
CAMCAVHAV1109.4°109.5°
CAMCAVHAV2109.5°109.4°
CAMCAVHAV3109.5°109.5°
HAM1CAMHAM2111.4°109.5°
HAV1CAVHAV2109.5°109.4°
HAV1CAVHAV3109.5°109.5°
HAV2CAVHAV3109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OAXCAWOAYCAR178.4°180.0°
OAXCAWCARCAQ161.7°180.0°
OAXCAWCARHAR146.4°60.0°
OAXCAWCARHAR278.3°60.0°
HAXOAXCAWOAY0.0°0.0°
HAXOAXCAWCAR178.4°179.9°
OAYCAWCARCAQ19.9°0.0°
OAYCAWCARHAR1135.1°120.0°
OAYCAWCARHAR2100.1°120.0°
CAWCARCAQHAR1115.2°120.0°
CAWCARCAQHAR2120.0°120.0°
CAWCARHAR1HAR2117.2°120.0°
CAWCARCAQCAP157.3°180.0°
CAWCARCAQHAQ179.3°60.0°
CAWCARCAQHAQ237.3°60.0°
CAQCARHAR1HAR2117.2°120.0°
CARCAQCAPHAQ1123.4°120.0°
CARCAQCAPHAQ2120.0°120.0°
CARCAQHAQ1HAQ2122.6°120.0°
CARCAQCAPCAO56.4°180.0°
CARCAQCAPHAP1179.3°60.1°
CARCAQCAPHAP263.6°60.0°
HAR1CARCAQCAP42.1°60.0°
HAR1CARCAQHAQ1165.5°180.0°
HAR1CARCAQHAQ277.9°60.0°
HAR2CARCAQCAP82.7°60.0°
HAR2CARCAQHAQ140.7°60.0°
HAR2CARCAQHAQ2157.3°180.0°
CAPCAQHAQ1HAQ2122.6°120.0°
CAQCAPCAOHAP1123.0°120.0°
CAQCAPCAOHAP2120.0°120.0°
CAQCAPHAP1HAP2122.3°120.1°
CAQCAPCAOCAN177.9°127.2°
CAQCAPCAOHAO2.0°52.7°
HAQ1CAQCAPCAO67.0°60.0°
HAQ1CAQCAPHAP155.9°180.0°
HAQ1CAQCAPHAP2173.0°60.0°
HAQ2CAQCAPCAO176.4°60.0°
HAQ2CAQCAPHAP160.7°59.9°
HAQ2CAQCAPHAP256.4°180.0°
CAOCAPHAP1HAP2122.3°120.0°
CAPCAOCANHAO180.0°180.0°
CAPCAOCANCAF1.4°8.5°
CAPCAOCANHAN178.6°171.6°
HAP1CAPCAOCAN59.1°112.8°
HAP1CAPCAOHAO120.9°67.2°
HAP2CAPCAOCAN57.9°7.2°
HAP2CAPCAOHAO122.0°172.7°
CAOCANCAFHAN180.0°179.9°
CAOCANCAFCAD2.8°125.6°
CAOCANCAFHAF1108.8°5.6°
CAOCANCAFHAF2122.8°114.5°
HAOCAOCANCAF178.5°171.5°
HAOCAOCANHAN1.5°8.4°
CANCAFCADHAF1111.6°120.0°
CANCAFCADHAF2120.0°120.0°
CANCAFHAF1HAF2115.2°120.1°
CANCAFCADCAC130.1°173.5°
CANCAFCADCAE123.3°72.2°
CANCAFCADHAD1.1°50.7°
HANCANCAFCAD177.2°54.4°
HANCANCAFHAF171.2°174.3°
HANCANCAFHAF257.2°65.6°
CADCAFHAF1HAF2115.2°119.9°
CAFCADCACCAE114.7°118.8°
CAFCADCACHAD122.9°122.7°
CAFCADCAEHAD125.3°122.8°
CAFCADCACCAB147.3°154.9°
CAFCADCACCAT44.3°53.1°
CAFCADCACHAC84.2°77.2°
CAFCADCAECAA103.5°119.9°
CAFCADCAECAG133.5°121.3°
CAFCADCAEHAE19.1°1.1°
HAF1CAFCADCAC118.4°66.5°
HAF1CAFCADCAE11.8°47.8°
HAF1CAFCADHAD112.6°170.7°
HAF2CAFCADCAC10.0°53.5°
HAF2CAFCADCAE116.6°167.8°
HAF2CAFCADHAD118.9°69.3°
CACCADCAEHAD129.3°118.6°
CADCACCABCAT108.8°105.7°
CADCACCABHAC124.5°128.1°
CADCACCATHAC124.7°130.6°
CADCACCABCAA53.1°55.7°
CADCACCABHAB1177.8°172.1°
CADCACCABHAB266.9°60.7°
CADCACCATOAS70.1°70.6°
CADCACCATHAT152.2°170.2°
CADCACCATHAT2169.9°48.2°
CACCADCAECAA1.8°1.3°
CACCADCAECAG121.2°120.1°
CACCADCAEHAE124.4°117.5°
CAECADCACCAB32.5°36.1°
CAECADCACCAT70.4°65.7°
CAECADCACHAC161.1°164.0°
CADCAECAACAB35.0°34.0°
CADCAECAAOAS70.2°71.7°
CADCAECAACAG125.7°118.7°
CADCAECAAHAE119.6°118.8°
CADCAECAAHAA162.8°159.8°
CADCAECAGHAE119.0°122.4°
CADCAECAGCAH179.7°121.8°
CADCAECAGHAG0.3°58.3°
HADCADCACCAB89.8°82.4°
HADCADCACCAT167.2°175.8°
HADCADCACHAC38.7°45.5°
HADCADCAECAA131.2°117.2°
HADCADCAECAG8.2°1.5°
HADCADCAEHAE106.3°123.9°
CABCACCATHAC126.9°126.3°
CACCABCAAHAB1124.7°116.4°
CACCABCAAHAB2120.0°116.4°
CACCABHAB1HAB2123.9°127.4°
CABCACCATOAS38.4°32.5°
CABCACCATHAT1160.6°86.7°
CABCACCATHAT281.6°151.3°
CACCABCAAOAS55.0°52.9°
CACCABCAACAE52.8°54.8°
CACCABCAAHAA178.7°179.5°
CATCACCABCAA55.6°50.0°
CATCACCABHAB169.0°66.4°
CATCACCABHAB2175.7°166.4°
CACCATOASHAT1122.3°119.2°
CACCATOASHAT2120.0°118.9°
CACCATHAT1HAT2121.6°121.9°
CACCATOASCAA3.9°1.0°
HACCACCABCAA177.7°176.1°
HACCACCABHAB157.7°59.8°
HACCACCABHAB257.7°67.5°
HACCACCATOAS165.3°158.8°
HACCACCATHAT172.5°39.5°
HACCACCATHAT245.3°82.4°
CAACABHAB1HAB2124.0°127.4°
CABCAAOASCAT32.2°34.6°
CABCAAOASCAE106.2°104.7°
CABCAAOASHAA127.4°126.8°
CABCAACAEHAA127.8°125.8°
CABCAACAECAG90.7°84.7°
CABCAACAEHAE154.6°152.8°
HAB1CABCAAOAS69.6°63.5°
HAB1CABCAACAE177.4°171.2°
HAB1CABCAAHAA56.7°63.1°
HAB2CABCAAOAS175.0°169.3°
HAB2CABCAACAE67.2°61.6°
HAB2CABCAAHAA58.7°64.1°
OASCATHAT1HAT2121.7°121.7°
CATOASCAACAE74.1°70.1°
CATOASCAAHAA159.6°161.4°
HAT1CATOASCAA126.2°120.2°
HAT2CATOASCAA116.1°117.9°
OASCAACAEHAA127.1°128.5°
OASCAACAECAG164.1°169.6°
OASCAACAEHAE49.4°47.1°
CAACAECAGHAE122.2°122.5°
CAACAECAGCAH61.0°123.1°
CAACAECAGHAG119.1°56.8°
HAACAACAECAG37.0°41.1°
HAACAACAEHAE77.6°81.4°
CAECAGCAHHAG180.0°180.0°
CAECAGCAHCAI178.7°180.0°
CAECAGCAHHAH1.3°0.0°
HAECAECAGCAH61.3°0.7°
HAECAECAGHAG118.7°179.3°
CAGCAHCAIHAH180.0°180.0°
CAGCAHCAIOAU113.9°120.0°
CAGCAHCAICAJ15.2°120.0°
CAGCAHCAIHAI129.6°0.0°
HAGCAGCAHCAI1.3°0.0°
HAGCAGCAHHAH178.7°180.0°
CAHCAIOAUCAJ129.7°120.0°
CAHCAIOAUHAI115.7°120.0°
CAHCAICAJHAI115.3°120.0°
CAHCAIOAUHAU143.1°60.0°
CAHCAICAJCAK89.8°175.0°
CAHCAICAJHAJ127.5°65.0°
CAHCAICAJHAJ2150.2°55.0°
HAHCAHCAIOAU66.0°60.0°
HAHCAHCAICAJ164.9°60.0°
HAHCAHCAIHAI50.5°180.0°
OAUCAICAJHAI116.3°120.0°
OAUCAICAJCAK38.7°65.0°
OAUCAICAJHAJ1156.0°55.0°
OAUCAICAJHAJ281.3°175.0°
CAJCAIOAUHAU13.4°60.0°
CAICAJCAKHAJ1117.3°120.0°
CAICAJCAKHAJ2120.0°119.9°
CAICAJHAJ1HAJ2118.3°119.9°
CAICAJCAKCAL141.8°180.0°
CAICAJCAKHAK198.9°60.0°
CAICAJCAKHAK221.8°60.0°
HAICAIOAUHAU101.2°180.0°
HAICAICAJCAK155.0°55.0°
HAICAICAJHAJ187.8°175.0°
HAICAICAJHAJ235.0°65.0°
CAKCAJHAJ1HAJ2118.3°120.1°
CAJCAKCALHAK1119.3°120.0°
CAJCAKCALHAK2120.0°120.0°
CAJCAKHAK1HAK2119.5°120.1°
CAJCAKCALCAM149.5°180.0°
CAJCAKCALHAL190.8°60.0°
CAJCAKCALHAL229.5°60.0°
HAJ1CAJCAKCAL24.6°60.0°
HAJ1CAJCAKHAK1143.8°180.0°
HAJ1CAJCAKHAK295.4°60.0°
HAJ2CAJCAKCAL98.2°60.1°
HAJ2CAJCAKHAK121.1°59.9°
HAJ2CAJCAKHAK2141.8°180.0°
CALCAKHAK1HAK2119.6°120.0°
CAKCALCAMHAL1119.7°120.0°
CAKCALCAMHAL2120.0°120.0°
CAKCALHAL1HAL2119.8°120.0°
CAKCALCAMCAV109.8°180.0°
CAKCALCAMHAM1131.2°60.0°
CAKCALCAMHAM210.2°60.1°
HAK1CAKCALCAM30.3°60.0°
HAK1CAKCALHAL1150.0°NaN°
HAK1CAKCALHAL289.8°60.0°
HAK2CAKCALCAM90.5°60.0°
HAK2CAKCALHAL129.2°60.0°
HAK2CAKCALHAL2149.5°180.0°
CAMCALHAL1HAL2119.8°120.1°
CALCAMCAVHAM1119.0°120.0°
CALCAMCAVHAM2120.0°120.0°
CALCAMHAM1HAM2119.3°120.1°
CALCAMCAVHAV158.4°60.0°
CALCAMCAVHAV261.6°180.0°
CALCAMCAVHAV3178.4°60.1°
HAL1CALCAMCAV9.9°60.0°
HAL1CALCAMHAM1109.1°180.0°
HAL1CALCAMHAM2129.9°59.9°
HAL2CALCAMCAV130.1°60.0°
HAL2CALCAMHAM111.2°60.0°
HAL2CALCAMHAM2109.9°180.0°
CAVCAMHAM1HAM2119.3°120.0°
CAMCAVHAV1HAV2120.0°120.0°
CAMCAVHAV1HAV3120.0°120.1°
CAMCAVHAV2HAV3120.0°120.0°
HAM1CAMCAVHAV1177.3°180.0°
HAM1CAMCAVHAV257.3°60.0°
HAM1CAMCAVHAV362.7°60.0°
HAM2CAMCAVHAV161.6°60.0°
HAM2CAMCAVHAV2178.4°60.0°
HAM2CAMCAVHAV358.3°180.0°
HAV1CAVHAV2HAV3120.0°120.0°

223532

PDB entries from 2024-08-07

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