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A1H7B

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CACOADsing1.43Å1.46Å
OADCBIsing1.36Å1.40Å
OABCAAsing1.43Å1.41Å
OABCBJsing1.36Å1.34Å
CBICBJdoub1.39Å1.37ÅAromatic
CBICBHsing1.39Å1.38ÅAromatic
OAFCAEsing1.43Å1.46Å
OAFCBHsing1.36Å1.37Å
NAJCAIdoub1.29Å1.34ÅAromatic
NAJCAKsing1.32Å1.37ÅAromatic
CAGCAKsing1.51Å1.54Å
CAISAHsing1.71Å1.82ÅAromatic
CBJCBKsing1.39Å1.41ÅAromatic
CAKCALdoub1.34Å1.35ÅAromatic
CBHCBGdoub1.39Å1.39ÅAromatic
CALSAHsing1.76Å1.67ÅAromatic
CALCAMsing1.51Å1.53Å
CAMOAOsing1.45Å1.49Å
CBKCBFdoub1.38Å1.40ÅAromatic
CBGCBFsing1.38Å1.38ÅAromatic
CBFCBEsing1.51Å1.42Å
OAOCsing1.34Å1.37Å
OCdoub1.21Å1.24Å
CCAsing1.51Å1.46Å
CAVCAWsing1.53Å1.55Å
CAVCBDsing1.53Å1.50Å
CBECBDsing1.53Å1.54Å
CBECBCsing1.51Å1.52Å
CAQNsing1.47Å1.51Å
CAQCARsing1.53Å1.53Å
CAWCAXsing1.53Å1.59Å
CBDCAZsing1.53Å1.56Å
CBCNsing1.35Å1.34Å
CBCOBBdoub1.21Å1.22Å
NCAsing1.47Å1.48Å
CACBsing1.53Å1.54Å
CARCASsing1.53Å1.48Å
CASCBsing1.53Å1.46Å
CAXCAYsing1.53Å1.49Å
CAZCAYsing1.53Å1.49Å
CAGHAKsing1.09Å1.10Å
CAGHALsing1.09Å1.10Å
CAGHAJsing1.09Å1.10Å
CAIHAMsing1.08Å1.08Å
CAMHANsing1.09Å1.10Å
CAMHAOsing1.09Å1.10Å
CAHAsing1.09Å1.10Å
CBHB2sing1.09Å1.10Å
CBHB1sing1.09Å1.10Å
CASHAVsing1.09Å1.10Å
CASHAUsing1.09Å1.10Å
CARHATsing1.09Å1.10Å
CARHASsing1.09Å1.10Å
CAQHARsing1.09Å1.10Å
CAQHAQsing1.09Å1.10Å
CBEHBEsing1.09Å1.10Å
CBDHBDsing1.09Å1.10Å
CAVHB3sing1.09Å1.10Å
CAVHB4sing1.09Å1.10Å
CAWHAWsing1.09Å1.10Å
CAWHB5sing1.09Å1.10Å
CAXHAXsing1.09Å1.10Å
CAXHB6sing1.09Å1.10Å
CAYHAYsing1.09Å1.10Å
CAYHB7sing1.09Å1.10Å
CAZHB8sing1.09Å1.10Å
CAZHAZsing1.09Å1.10Å
CBKHBKsing1.08Å1.08Å
CBGHBGsing1.08Å1.08Å
CAEHAIsing1.09Å1.10Å
CAEHAGsing1.09Å1.10Å
CAEHAHsing1.09Å1.10Å
CACHAFsing1.09Å1.10Å
CACHADsing1.09Å1.10Å
CACHAEsing1.09Å1.10Å
CAAHAAsing1.09Å1.10Å
CAAHABsing1.09Å1.10Å
CAAHACsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CACOADCBI119.3°117.0°
OADCACHAF109.5°109.5°
OADCACHAD109.4°109.5°
OADCACHAE109.5°109.4°
OADCBICBJ117.3°120.1°
OADCBICBH123.5°120.1°
CAAOABCBJ115.0°117.0°
OABCAAHAA109.5°109.5°
OABCAAHAB109.4°109.5°
OABCAAHAC109.5°109.5°
OABCBJCBI112.7°120.0°
OABCBJCBK126.0°120.1°
CBJCBICBH119.2°119.8°
CBICBJCBK121.3°119.9°
CBICBHOAF119.7°120.0°
CBICBHCBG119.4°119.9°
CAEOAFCBH115.0°117.0°
OAFCAEHAI109.5°109.5°
OAFCAEHAG109.5°109.5°
OAFCAEHAH109.4°109.5°
OAFCBHCBG120.9°120.1°
CAINAJCAK113.0°117.1°
NAJCAISAH108.3°110.1°
NAJCAIHAM125.8°124.9°
NAJCAKCAG122.8°122.7°
NAJCAKCAL116.8°114.5°
CAGCAKCAL120.4°122.8°
CAKCAGHAK109.5°109.4°
CAKCAGHAL109.5°109.5°
CAKCAGHAJ109.4°109.5°
CAISAHCAL91.4°90.3°
SAHCAIHAM125.9°124.9°
CBJCBKCBF120.1°120.1°
CBJCBKHBK119.9°119.9°
CAKCALSAH110.5°107.9°
CAKCALCAM126.7°126.0°
CBHCBGCBF123.1°120.1°
CBHCBGHBG118.5°120.0°
SAHCALCAM122.8°126.1°
CALCAMOAO107.7°109.5°
CALCAMHAN109.9°109.5°
CALCAMHAO109.9°109.5°
CAMOAOC123.1°117.1°
OAOCAMHAN109.9°109.4°
OAOCAMHAO109.9°109.5°
CBKCBFCBG117.0°120.2°
CBKCBFCBE124.1°119.9°
CBFCBKHBK120.0°119.9°
CBGCBFCBE118.9°120.0°
CBFCBGHBG118.4°119.9°
CBFCBECBD107.6°109.5°
CBFCBECBC110.3°109.5°
CBFCBEHBE111.1°109.5°
OAOCO121.3°119.9°
OAOCCA115.9°120.1°
OCCA122.8°120.0°
CCAN106.2°109.6°
CCACB114.3°109.6°
CCAHA110.0°109.6°
CAWCAVCBD110.5°109.5°
CAVCAWCAX113.1°109.5°
CAWCAVHB3109.2°109.5°
CAWCAVHB4109.2°109.5°
CAVCAWHAW108.6°109.5°
CAVCAWHB5108.5°109.4°
CAVCBDCBE109.7°109.5°
CAVCBDCAZ111.1°109.5°
CAVCBDHBD109.2°109.5°
CBDCAVHB3109.2°109.5°
CBDCAVHB4109.2°109.4°
CBDCBECBC108.5°109.5°
CBECBDCAZ109.7°109.5°
CBDCBEHBE109.5°109.4°
CBECBDHBD108.7°109.4°
CBECBCN121.4°120.0°
CBECBCOBB118.5°120.0°
CBCCBEHBE109.8°109.5°
NCAQCAR113.5°108.7°
CAQNCBC127.6°120.6°
CAQNCA115.2°118.8°
NCAQHAR108.5°109.6°
NCAQHAQ108.4°109.6°
CAQCARCAS109.6°109.3°
CAQCARHAT109.4°109.5°
CAQCARHAS109.4°109.5°
CARCAQHAR108.4°109.6°
CARCAQHAQ108.5°109.6°
CAWCAXCAY104.5°109.4°
CAXCAWHAW108.5°109.5°
CAXCAWHB5108.6°109.5°
CAWCAXHAX110.7°109.5°
CAWCAXHB6110.7°109.5°
CBDCAZCAY111.2°109.5°
CAZCBDHBD108.4°109.5°
CBDCAZHB8109.0°109.4°
CBDCAZHAZ109.0°109.5°
NCBCOBB120.0°120.0°
CBCNCA116.6°120.6°
NCACB107.4°108.8°
NCAHA109.8°109.7°
CACBCAS108.8°109.3°
CBCAHA109.0°109.6°
CACBHB2109.6°109.5°
CACBHB1109.6°109.5°
CARCASCB109.3°109.5°
CARCASHAV109.5°109.5°
CARCASHAU109.5°109.5°
CASCARHAT109.4°109.5°
CASCARHAS109.4°109.5°
CASCBHB2109.6°109.5°
CASCBHB1109.6°109.6°
CBCASHAV109.5°109.4°
CBCASHAU109.5°109.4°
CAXCAYCAZ110.4°109.5°
CAYCAXHAX110.7°109.5°
CAYCAXHB6110.7°109.4°
CAXCAYHAY109.3°109.5°
CAXCAYHB7109.2°109.4°
CAZCAYHAY109.2°109.5°
CAZCAYHB7109.2°109.5°
CAYCAZHB8109.0°109.5°
CAYCAZHAZ109.0°109.5°
HAKCAGHAL109.4°109.5°
HAKCAGHAJ109.5°109.5°
HALCAGHAJ109.5°109.5°
HANCAMHAO109.5°109.5°
HB2CBHB1109.5°109.5°
HAVCASHAU109.5°109.5°
HATCARHAS109.5°109.5°
HARCAQHAQ109.5°109.7°
HB3CAVHB4109.5°109.5°
HAWCAWHB5109.5°109.5°
HAXCAXHB6109.4°109.5°
HAYCAYHB7109.5°109.5°
HB8CAZHAZ109.5°109.5°
HAICAEHAG109.5°109.4°
HAICAEHAH109.5°109.5°
HAGCAEHAH109.5°109.5°
HAFCACHAD109.4°109.5°
HAFCACHAE109.5°109.4°
HADCACHAE109.5°109.4°
HAACAAHAB109.5°109.4°
HAACAAHAC109.4°109.5°
HABCAAHAC109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CACOADCBICBJ139.0°90.0°
CACOADCBICBH40.0°89.7°
OADCACHAFHAD120.0°120.1°
OADCACHAFHAE120.0°120.0°
OADCACHADHAE120.0°120.0°
OADCBICBJOAB2.0°0.3°
OADCBICBJCBH179.1°179.7°
OADCBICBHOAF0.6°0.0°
OADCBICBJCBK179.9°180.0°
OADCBICBHCBG179.8°180.0°
CBIOADCACHAF180.0°60.0°
CBIOADCACHAD60.0°60.0°
CBIOADCACHAE60.0°180.0°
CAAOABCBJCBI151.7°180.0°
CAAOABCBJCBK30.5°0.2°
OABCAAHAAHAB120.0°120.0°
OABCAAHAAHAC120.0°120.0°
OABCAAHABHAC120.0°120.0°
OABCBJCBICBK177.9°179.7°
OABCBJCBICBH178.9°180.0°
OABCBJCBKCBF178.0°179.8°
OABCBJCBKHBK2.0°0.2°
CBJOABCAAHAA180.0°179.9°
CBJOABCAAHAB60.0°60.0°
CBJOABCAAHAC60.0°60.0°
CBJCBICBHOAF179.6°179.7°
CBJCBICBHCBG0.8°0.3°
CBICBJCBKCBF0.4°0.0°
CBICBJCBKHBK179.6°180.0°
CBICBHOAFCAE131.1°180.0°
CBICBHOAFCBG179.6°180.0°
CBHCBICBJCBK1.1°0.3°
CBICBHCBGCBF0.2°0.0°
CBICBHCBGHBG179.8°180.0°
CAEOAFCBHCBG49.3°0.0°
OAFCAEHAIHAG120.0°120.0°
OAFCAEHAIHAH120.0°120.0°
OAFCAEHAGHAH120.0°120.0°
OAFCBHCBGCBF179.4°180.0°
OAFCBHCBGHBG0.6°0.0°
CBHOAFCAEHAI180.0°60.0°
CBHOAFCAEHAG60.0°180.0°
CBHOAFCAEHAH60.0°60.0°
CAINAJCAKCAG179.1°180.0°
NAJCAISAHHAM180.0°180.0°
CAINAJCAKCAL0.2°0.2°
NAJCAISAHCAL1.2°0.2°
NAJCAKCAGCAL179.3°179.7°
CAKNAJCAISAH1.0°0.0°
NAJCAKCALSAH0.8°0.3°
NAJCAKCALCAM178.4°179.8°
NAJCAKCAGHAK0.0°89.7°
NAJCAKCAGHAL120.0°30.3°
NAJCAKCAGHAJ120.0°150.3°
CAKNAJCAIHAM178.9°180.0°
CAGCAKCALSAH179.9°179.9°
CAGCAKCALCAM2.3°0.1°
CAKCAGHAKHAL120.0°120.0°
CAKCAGHAKHAJ120.0°120.0°
CAKCAGHALHAJ120.0°120.0°
CAISAHCALCAK1.1°0.3°
CAISAHCALCAM178.8°179.8°
CBJCBKCBFHBK180.0°180.0°
CBJCBKCBFCBG0.5°0.3°
CBJCBKCBFCBE178.5°180.0°
CAKCALSAHCAM177.7°179.9°
CAKCALCAMOAO78.2°90.0°
CALCAKCAGHAK179.3°90.0°
CALCAKCAGHAL60.7°150.0°
CALCAKCAGHAJ59.3°30.0°
CAKCALCAMHAN162.1°150.0°
CAKCALCAMHAO41.5°30.0°
CBHCBGCBFCBK0.8°0.3°
CBHCBGCBFHBG180.0°180.0°
CBHCBGCBFCBE178.3°180.0°
SAHCALCAMOAO99.1°89.8°
CALSAHCAIHAM178.7°179.8°
SAHCALCAMHAN20.6°30.1°
SAHCALCAMHAO141.1°150.1°
CALCAMOAOHAN119.8°120.0°
CALCAMOAOHAO119.7°120.0°
CALCAMOAOC89.9°180.0°
CALCAMHANHAO120.8°120.0°
CAMOAOCO13.6°0.0°
CAMOAOCCA167.2°180.0°
OAOCAMHANHAO120.8°120.0°
CBKCBFCBGCBE179.1°179.8°
CBKCBFCBECBD62.9°120.0°
CBKCBFCBECBC55.3°120.0°
CBKCBFCBEHBE177.2°0.0°
CBKCBFCBGHBG179.2°179.7°
CBGCBFCBECBD116.1°59.7°
CBGCBFCBECBC125.7°60.2°
CBGCBFCBEHBE3.8°179.7°
CBGCBFCBKHBK179.5°179.8°
CBFCBECBDCAV52.5°55.0°
CBFCBECBDCBC119.3°120.0°
CBFCBECBDHBE120.9°120.1°
CBFCBECBCHBE122.8°120.1°
CBFCBECBDCAZ174.8°175.1°
CBFCBECBCN84.5°85.3°
CBFCBECBCOBB92.5°94.6°
CBFCBECBDHBD66.8°65.0°
CBECBFCBKHBK1.5°0.0°
CBECBFCBGHBG1.7°0.0°
OAOCOCA179.2°180.0°
OAOCCAN3.5°114.7°
OAOCCACB121.7°126.0°
COAOCAMHAN29.9°60.0°
COAOCAMHAO150.4°60.0°
OAOCCAHA115.3°5.8°
OCCAN175.7°65.3°
OCCACB57.5°54.0°
OCCAHA65.5°174.2°
CCANCAQ72.1°173.4°
CCANCBC99.5°6.6°
CCANCB122.7°119.8°
CCANHA118.9°120.4°
CCACBHA123.5°120.2°
CCACBCAS55.1°174.4°
CCACBHB264.8°54.5°
CCACBHB1174.9°65.5°
CAWCAVCBDHB3120.2°120.0°
CAWCAVCBDHB4120.1°120.0°
CAWCAVCBDCBE170.9°180.0°
CAVCAWCAXHAW120.5°120.0°
CAVCAWCAXHB5120.5°120.0°
CAWCAVCBDCAZ49.5°59.9°
CAVCAWCAXCAY59.6°60.0°
CAWCAVCBDHBD70.1°60.0°
CAWCAVHB3HB4119.5°120.1°
CAVCAWHAWHB5118.3°119.9°
CAVCAWCAXHAX178.8°180.0°
CAVCAWCAXHB659.6°59.9°
CAVCBDCBECAZ122.3°120.0°
CAVCBDCBEHBD119.3°120.0°
CAVCBDCBECBC171.8°175.0°
CBDCAVCAWCAX53.8°60.0°
CAVCBDCAZHBD120.0°120.0°
CAVCBDCAZCAY55.6°60.0°
CAVCBDCBEHBE68.4°65.0°
CBDCAVHB3HB4119.6°119.9°
CBDCAVCAWHAW66.7°60.1°
CBDCAVCAWHB5174.4°180.0°
CAVCBDCAZHB864.7°60.0°
CAVCBDCAZHAZ175.8°180.0°
CBDCBECBCHBE119.6°119.9°
CBECBDCAZHBD118.5°120.0°
CBDCBECBCN157.8°154.7°
CBDCBECBCOBB25.1°25.4°
CBECBDCAZCAY177.0°180.0°
CBECBDCAVHB350.7°60.0°
CBECBDCAVHB469.0°60.0°
CBECBDCAZHB856.8°60.0°
CBECBDCAZHAZ62.7°60.0°
CBECBCNCAQ0.4°3.6°
CBCCBECBDCAZ65.9°64.9°
CBECBCNOBB177.0°180.0°
CBECBCNCA170.8°176.4°
CBCCBECBDHBD52.5°55.0°
NCAQCARHAR120.6°119.8°
NCAQCARHAQ120.6°119.7°
CAQNCBCCA170.4°180.0°
CAQNCBCOBB176.6°176.4°
CAQNCACB50.6°53.6°
NCAQCARCAS47.2°54.6°
CAQNCAHA169.0°66.2°
NCAQCARHAT72.8°65.4°
NCAQCARHAS167.2°174.6°
NCAQHARHAQ118.1°120.4°
CARCAQNCBC144.7°126.4°
CARCAQNCA44.8°53.6°
CAQCARCASHAT120.0°120.0°
CAQCARCASHAS120.0°119.9°
CAQCARCASCB60.2°61.4°
CAQCARCASHAV179.8°178.6°
CAQCARCASHAU59.8°58.6°
CAQCARHATHAS119.9°120.0°
CARCAQHARHAQ118.2°120.4°
CAWCAXCAYHAX119.2°120.0°
CAWCAXCAYHB6119.2°120.0°
CAWCAXCAYCAZ64.1°60.0°
CAXCAWCAVHB366.3°180.0°
CAXCAWCAVHB4174.0°59.9°
CAXCAWHAWHB5118.3°120.0°
CAWCAXHAXHB6122.3°120.1°
CAWCAXCAYHAY56.1°60.0°
CAWCAXCAYHB7175.8°180.0°
CBDCAZCAYCAX65.0°60.0°
CBDCAZCAYHB8120.3°120.0°
CBDCAZCAYHAZ120.2°120.0°
CAZCBDCBEHBE53.8°55.0°
CAZCBDCAVHB370.7°180.0°
CAZCBDCAVHB4169.6°60.0°
CBDCAZCAYHAY55.2°60.0°
CBDCAZCAYHB7174.9°180.0°
CBDCAZHB8HAZ119.2°120.0°
CBCNCACB137.8°126.4°
CBCNCAHA19.4°113.8°
CBCNCAQHAR24.1°6.6°
CBCNCAQHAQ94.7°113.8°
NCBCCBEHBE38.2°34.7°
OBBCBCNCA6.2°3.6°
OBBCBCCBEHBE144.7°145.3°
NCACBHA118.9°119.9°
NCACBCAS62.5°54.6°
NCACBHB2177.6°65.3°
NCACBHB157.3°174.6°
CANCAQHAR165.4°173.4°
CANCAQHAQ75.8°66.1°
CACBCASCAR69.3°61.4°
CACBCASHB2119.9°119.9°
CACBCASHB1119.9°120.0°
CACBHB2HB1120.3°120.1°
CACBCASHAV170.7°178.6°
CACBCASHAU50.6°58.7°
CARCASCBHAV120.0°120.0°
CARCASCBHAU120.0°120.0°
CARCASCBHB2170.8°58.5°
CARCASCBHB150.6°178.7°
CARCASHAVHAU120.1°120.0°
CASCARHATHAS120.0°120.1°
CASCARCAQHAR167.8°174.4°
CASCARCAQHAQ73.4°65.1°
CASCBCAHA178.6°65.3°
CASCBHB2HB1120.3°120.2°
CBCASHAVHAU120.1°119.9°
CBCASCARHAT59.8°58.6°
CBCASCARHAS179.8°178.6°
CAXCAYCAZHAY120.2°120.1°
CAXCAYCAZHB7120.1°120.0°
CAYCAXCAWHAW60.9°60.0°
CAYCAXCAWHB5179.8°180.0°
CAYCAXHAXHB6122.3°120.0°
CAXCAYHAYHB7119.6°120.0°
CAXCAYCAZHB855.3°59.9°
CAXCAYCAZHAZ174.8°180.0°
CAYCAZCBDHBD64.4°60.0°
CAZCAYCAXHAX176.7°179.9°
CAZCAYCAXHB655.2°59.9°
CAZCAYHAYHB7119.6°120.0°
CAYCAZHB8HAZ119.2°120.0°
HAKCAGHALHAJ120.0°120.0°
HACACBHB258.7°174.8°
HACACBHB161.5°54.7°
HB2CBCASHAV50.8°61.5°
HB2CBCASHAU69.3°178.5°
HB1CBCASHAV69.4°58.7°
HB1CBCASHAU170.5°61.3°
HAVCASCARHAT60.2°61.4°
HAVCASCARHAS59.8°58.6°
HAUCASCARHAT179.8°178.6°
HAUCASCARHAS60.2°61.4°
HATCARCAQHAR47.8°54.4°
HATCARCAQHAQ166.6°174.9°
HASCARCAQHAR72.2°65.6°
HASCARCAQHAQ46.6°54.9°
HBECBECBDHBD172.2°175.0°
HBDCBDCAVHB3169.7°60.0°
HBDCBDCAVHB450.1°180.0°
HBDCBDCAZHB8175.3°180.0°
HBDCBDCAZHAZ55.8°60.0°
HB3CAVCAWHAW173.1°59.9°
HB3CAVCAWHB554.2°60.0°
HB4CAVCAWHAW53.5°180.0°
HB4CAVCAWHB565.4°60.1°
HAWCAWCAXHAX58.3°60.0°
HAWCAWCAXHB6179.8°179.9°
HB5CAWCAXHAX60.6°60.0°
HB5CAWCAXHB660.9°60.0°
HAXCAXCAYHAY63.2°60.0°
HAXCAXCAYHB756.6°60.0°
HB6CAXCAYHAY175.3°180.0°
HB6CAXCAYHB765.0°60.0°
HAYCAYCAZHB8175.5°NaN°
HAYCAYCAZHAZ65.0°59.9°
HB7CAYCAZHB864.8°60.0°
HB7CAYCAZHAZ54.7°60.0°
HAICAEHAGHAH120.0°120.0°
HAFCACHADHAE120.0°120.0°
HAACAAHABHAC120.0°120.0°

223532

PDB entries from 2024-08-07

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