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04M

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAMCAAsing1.53Å1.53Å
CAAHAAsing1.09Å1.10Å
CAAHAAAsing1.09Å1.10Å
CAAHAABsing1.09Å1.10Å
CBBOABsing1.35Å1.26Å
OABHOABsing0.97Å0.95Å
OACSBIdoub1.42Å1.50Å
OADSBIdoub1.42Å1.50Å
OAECBBdoub1.21Å1.25Å
CAGCAFdoub1.38Å1.39ÅAromatic
CAFCAHsing1.38Å1.39ÅAromatic
CAFHAFsing1.08Å1.08Å
CAGCBCsing1.38Å1.39ÅAromatic
CAGHAGsing1.08Å1.08Å
CAHCBDdoub1.39Å1.39ÅAromatic
CAHHAHsing1.08Å1.08Å
CBECAIdoub1.39Å1.39ÅAromatic
CAICAJsing1.38Å1.40ÅAromatic
CAIHAIsing1.08Å1.08Å
CAJCBFdoub1.39Å1.39ÅAromatic
CAJHAJsing1.08Å1.08Å
CBCCAKdoub1.38Å1.39ÅAromatic
CAKCBDsing1.39Å1.39ÅAromatic
CAKHAKsing1.08Å1.08Å
CBECALsing1.38Å1.39ÅAromatic
CALCBGdoub1.40Å1.40ÅAromatic
CALHALsing1.08Å1.08Å
CANCAMsing1.53Å1.53Å
CAMHAMsing1.09Å1.10Å
CAMHAMAsing1.09Å1.10Å
CAOCANsing1.53Å1.54Å
CANHANsing1.09Å1.10Å
CANHANAsing1.09Å1.10Å
CAOCAPsing1.53Å1.53Å
CAOHAOsing1.09Å1.10Å
CAOHAOAsing1.09Å1.10Å
CAQCAPsing1.53Å1.54Å
CAPHAPsing1.09Å1.10Å
CAPHAPAsing1.09Å1.10Å
CARCAQsing1.53Å1.54Å
CAQHAQsing1.09Å1.10Å
CAQHAQAsing1.09Å1.10Å
CASCARsing1.53Å1.54Å
CARHARsing1.09Å1.10Å
CARHARAsing1.09Å1.10Å
OAZCASsing1.43Å1.44Å
CASHASsing1.09Å1.10Å
CASHASAsing1.09Å1.10Å
OAYCATsing1.43Å1.40Å
CAWCATsing1.53Å1.50Å
CATHATsing1.09Å1.10Å
CATHATAsing1.09Å1.10Å
CAXCAUsing1.54Å1.50Å
CAUOAYsing1.43Å1.41Å
CAUHAUsing1.09Å1.10Å
CAUHAUAsing1.09Å1.10Å
OBACAVsing1.43Å1.44Å
CAVCBCsing1.51Å1.39Å
CAVHAVsing1.09Å1.10Å
CAVHAVAsing1.09Å1.10Å
NBHCAWsing1.47Å1.47Å
CAWHAWsing1.09Å1.10Å
CAWHAWAsing1.09Å1.10Å
CAXNBHsing1.47Å1.48Å
CAXHAXsing1.09Å1.10Å
CAXHAXAsing1.09Å1.10Å
CBDOAZsing1.36Å1.36Å
CBFOBAsing1.36Å1.37Å
CBGCBBsing1.47Å1.54Å
SBICBEsing1.76Å1.77Å
CBGCBFsing1.40Å1.40ÅAromatic
SBINBHsing1.66Å1.60Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAMCAAHAA109.5°109.5°
CAMCAAHAAA109.5°109.5°
CAMCAAHAAB109.5°109.5°
CAACAMCAN110.7°109.5°
CAACAMHAM109.1°109.4°
CAACAMHAMA109.1°109.5°
HAACAAHAAA109.5°109.5°
HAACAAHAAB109.4°109.4°
HAAACAAHAAB109.5°109.5°
CBBOABHOAB109.5°117.0°
OABCBBOAE124.1°120.0°
OABCBBCBG119.4°120.0°
OACSBIOAD110.7°123.2°
OACSBICBE109.8°106.4°
OACSBINBH105.9°106.4°
OADSBICBE110.1°106.4°
OADSBINBH107.8°106.4°
OAECBBCBG116.4°120.0°
CAGCAFCAH120.2°120.0°
CAGCAFHAF119.9°120.0°
CAFCAGCBC119.9°120.1°
CAFCAGHAG120.0°119.9°
CAHCAFHAF119.9°119.9°
CAFCAHCBD120.3°120.0°
CAFCAHHAH119.8°120.0°
CBCCAGHAG120.0°119.9°
CAGCBCCAK119.9°120.0°
CAGCBCCAV119.4°120.0°
CBDCAHHAH119.9°120.0°
CAHCBDCAK119.3°119.9°
CAHCBDOAZ119.8°120.0°
CBECAICAJ120.2°120.4°
CBECAIHAI119.9°119.8°
CAICBECAL118.8°120.4°
CAICBESBI121.6°119.8°
CAJCAIHAI119.9°119.8°
CAICAJCBF120.8°120.1°
CAICAJHAJ119.6°119.9°
CBFCAJHAJ119.6°120.0°
CAJCBFOBA120.3°120.1°
CAJCBFCBG118.9°119.7°
CBCCAKCBD120.2°120.0°
CBCCAKHAK119.9°120.0°
CAKCBCCAV120.7°120.0°
CBDCAKHAK119.9°120.0°
CAKCBDOAZ120.6°120.1°
CBECALCBG121.1°119.8°
CBECALHAL119.5°120.1°
CALCBESBI119.3°119.8°
CBGCALHAL119.5°120.0°
CALCBGCBB118.8°120.2°
CALCBGCBF119.8°119.6°
CANCAMHAM109.0°109.4°
CANCAMHAMA109.1°109.5°
CAMCANCAO111.4°109.4°
CAMCANHAN108.8°109.4°
CAMCANHANA108.9°109.5°
HAMCAMHAMA109.9°109.5°
CAOCANHAN108.9°109.4°
CAOCANHANA108.8°109.5°
CANCAOCAP112.9°109.4°
CANCAOHAO108.3°109.5°
CANCAOHAOA108.3°109.5°
HANCANHANA110.1°109.5°
CAPCAOHAO108.3°109.5°
CAPCAOHAOA108.4°109.5°
CAOCAPCAQ110.5°109.5°
CAOCAPHAP109.1°109.5°
CAOCAPHAPA109.1°109.5°
HAOCAOHAOA110.6°109.5°
CAQCAPHAP109.1°109.5°
CAQCAPHAPA109.1°109.4°
CAPCAQCAR111.8°109.5°
CAPCAQHAQ108.7°109.5°
CAPCAQHAQA108.7°109.4°
HAPCAPHAPA109.8°109.5°
CARCAQHAQ108.7°109.5°
CARCAQHAQA108.7°109.5°
CAQCARCAS110.8°109.5°
CAQCARHAR109.0°109.4°
CAQCARHARA109.0°109.4°
HAQCAQHAQA110.2°109.5°
CASCARHAR109.0°109.5°
CASCARHARA109.0°109.5°
CARCASOAZ111.7°109.5°
CARCASHAS108.7°109.5°
CARCASHASA108.7°109.5°
HARCARHARA109.9°109.5°
OAZCASHAS108.7°109.4°
OAZCASHASA108.7°109.4°
CASOAZCBD112.8°117.1°
HASCASHASA110.2°109.5°
OAYCATCAW90.5°109.3°
OAYCATHAT116.4°109.5°
OAYCATHATA116.4°109.5°
CATOAYCAU100.9°114.2°
CAWCATHAT116.4°109.5°
CAWCATHATA116.4°109.5°
CATCAWNBH108.1°108.4°
CATCAWHAW109.9°109.7°
CATCAWHAWA110.0°109.7°
HATCATHATA101.8°109.5°
CAXCAUOAY92.2°109.2°
CAXCAUHAU115.7°109.6°
CAXCAUHAUA115.7°109.6°
CAUCAXNBH109.3°108.4°
CAUCAXHAX109.6°109.7°
CAUCAXHAXA109.5°109.7°
OAYCAUHAU115.7°109.5°
OAYCAUHAUA115.7°109.5°
HAUCAUHAUA102.6°109.5°
OBACAVCBC119.4°109.4°
OBACAVHAV106.3°109.4°
OBACAVHAVA106.3°109.4°
CAVOBACBF112.9°117.0°
CBCCAVHAV106.3°109.5°
CBCCAVHAVA106.3°109.5°
HAVCAVHAVA112.4°109.5°
NBHCAWHAW109.9°109.6°
NBHCAWHAWA109.9°109.7°
CAWNBHCAX111.5°118.1°
CAWNBHSBI103.9°121.0°
HAWCAWHAWA109.0°109.7°
NBHCAXHAX109.5°109.7°
NBHCAXHAXA109.6°109.7°
CAXNBHSBI100.6°121.0°
HAXCAXHAXA109.4°109.7°
OBACBFCBG120.4°120.2°
CBBCBGCBF121.0°120.2°
CBESBINBH112.3°107.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAMCAAHAAHAAA120.0°120.1°
CAMCAAHAAHAAB120.0°119.9°
CAMCAAHAAAHAAB120.0°120.1°
CAACAMCANHAM120.0°119.9°
CAACAMCANHAMA120.0°120.0°
CAACAMHAMHAMA119.5°120.0°
CAACAMCANCAO171.4°180.0°
CAACAMCANHAN68.6°60.1°
CAACAMCANHANA51.4°60.0°
HAACAAHAAAHAAB120.0°119.9°
HAACAACAMCAN180.0°180.0°
HAACAACAMHAM60.0°60.1°
HAACAACAMHAMA60.0°59.9°
HAAACAACAMCAN60.0°60.0°
HAAACAACAMHAM60.0°59.9°
HAAACAACAMHAMA180.0°180.0°
HAABCAACAMCAN60.0°60.1°
HAABCAACAMHAM180.0°180.0°
HAABCAACAMHAMA60.0°59.9°
OABCBBOAECBG177.7°180.0°
OABCBBCBGCAL149.2°0.0°
OABCBBCBGCBF37.9°179.2°
HOABOABCBBOAE0.0°0.0°
HOABOABCBBCBG177.6°180.0°
OACSBIOADCBE121.6°123.0°
OACSBIOADNBH115.5°122.9°
OACSBICBECAI154.8°156.5°
OACSBICBECAL31.8°23.5°
OACSBINBHCAW62.7°156.4°
OACSBINBHCAX52.8°23.5°
OACSBICBENBH117.6°113.5°
OADSBICBECAI83.0°23.5°
OADSBICBECAL90.4°156.5°
OADSBINBHCAW178.7°23.5°
OADSBINBHCAX65.8°156.5°
OADSBICBENBH120.2°113.5°
OAECBBCBGCAL33.0°180.0°
OAECBBCBGCBF139.9°0.8°
CAGCAFCAHHAF180.0°179.8°
CAFCAGCBCHAG180.0°179.9°
CAGCAFCAHCBD1.4°0.2°
CAGCAFCAHHAH178.6°179.7°
CAFCAGCBCCAK0.3°0.0°
CAFCAGCBCCAV179.2°179.9°
CAHCAFCAGCBC1.0°0.0°
CAHCAFCAGHAG179.0°179.9°
CAFCAHCBDHAH180.0°179.9°
CAFCAHCBDCAK4.4°0.4°
CAFCAHCBDOAZ178.6°180.0°
HAFCAFCAGCBC179.0°179.8°
HAFCAFCAGHAG1.0°0.3°
HAFCAFCAHCBD178.6°180.0°
HAFCAFCAHHAH1.4°0.1°
CAGCBCCAKCAV178.9°179.9°
CAGCBCCAKCBD2.7°0.2°
CAGCBCCAKHAK177.3°179.8°
CAGCBCCAVOBA49.5°90.0°
CAGCBCCAVHAV169.5°30.0°
CAGCBCCAVHAVA70.6°150.1°
HAGCAGCBCCAK179.6°179.9°
HAGCAGCBCCAV0.7°0.0°
CAHCBDCAKCBC5.0°0.5°
CAHCBDCAKOAZ174.1°179.5°
CAHCBDCAKHAK174.9°180.0°
CAHCBDOAZCAS74.4°0.0°
HAHCAHCBDCAK175.6°179.5°
HAHCAHCBDOAZ1.4°0.0°
CBECAICAJHAI180.0°179.7°
CBECAICAJCBF2.9°0.3°
CBECAICAJHAJ177.1°179.8°
CAICBECALSBI173.5°180.0°
CAICBECALCBG4.2°0.5°
CAICBECALHAL175.7°179.5°
CAICBESBINBH37.2°90.0°
CAICAJCBFHAJ180.0°179.9°
CAJCAICBECAL6.6°0.0°
CAICAJCBFOBA175.3°180.0°
CAJCAICBESBI180.0°180.0°
CAICAJCBFCBG3.2°0.0°
HAICAICAJCBF177.1°180.0°
HAICAICAJHAJ2.9°0.1°
HAICAICBECAL173.4°179.7°
HAICAICBESBI0.0°0.3°
CAJCBFCBGCAL5.6°0.5°
CAJCBFOBACAV76.4°0.0°
CAJCBFOBACBG171.9°180.0°
CAJCBFCBGCBB178.4°179.7°
HAJCAJCBFOBA4.8°0.1°
HAJCAJCBFCBG176.8°179.9°
CBCCAKCBDHAK180.0°179.6°
CAKCBCCAVOBA131.6°90.1°
CAKCBCCAVHAV11.6°149.9°
CAKCBCCAVHAVA108.4°29.9°
CBCCAKCBDOAZ179.2°180.0°
CAKCBDOAZCAS111.5°179.5°
CBDCAKCBCCAV176.2°179.7°
HAKCAKCBCCAV3.8°0.1°
HAKCAKCBDOAZ0.8°0.5°
CBECALCBGHAL180.0°180.0°
CBECALCBGCBB174.9°180.0°
CBECALCBGCBF1.9°0.8°
CALCBESBINBH149.4°90.0°
CALCBGCBFOBA177.6°179.5°
CALCBGCBBCBF172.9°179.2°
CBGCALCBESBI177.8°179.5°
HALCALCBGCBB5.2°0.0°
HALCALCBESBI2.2°0.5°
HALCALCBGCBF178.1°179.2°
CANCAMHAMHAMA119.5°120.1°
CAMCANCAOHAN120.0°119.9°
CAMCANCAOHANA120.0°120.0°
CAMCANHANHANA119.2°120.1°
CAMCANCAOCAP19.6°179.9°
CAMCANCAOHAO100.4°60.0°
CAMCANCAOHAOA139.6°60.0°
HAMCAMCANCAO51.4°60.1°
HAMCAMCANHAN171.4°NaN°
HAMCAMCANHANA68.6°59.9°
HAMACAMCANCAO68.6°60.0°
HAMACAMCANHAN51.4°59.9°
HAMACAMCANHANA171.4°180.0°
CAOCANHANHANA119.2°120.0°
CANCAOCAPHAO120.0°120.0°
CANCAOCAPHAOA120.0°120.0°
CANCAOHAOHAOA118.6°120.0°
CANCAOCAPCAQ145.7°180.0°
CANCAOCAPHAP94.3°60.0°
CANCAOCAPHAPA25.7°60.0°
HANCANCAOCAP139.6°60.0°
HANCANCAOHAO19.6°180.0°
HANCANCAOHAOA100.4°60.0°
HANACANCAOCAP100.4°60.0°
HANACANCAOHAO139.6°60.0°
HANACANCAOHAOA19.6°180.0°
CAPCAOHAOHAOA118.6°120.0°
CAOCAPCAQHAP120.0°120.1°
CAOCAPCAQHAPA120.0°120.0°
CAOCAPHAPHAPA119.6°120.0°
CAOCAPCAQCAR68.1°180.0°
CAOCAPCAQHAQ51.9°59.9°
CAOCAPCAQHAQA171.9°60.0°
HAOCAOCAPCAQ25.7°60.0°
HAOCAOCAPHAP145.7°180.0°
HAOCAOCAPHAPA94.3°60.0°
HAOACAOCAPCAQ94.3°60.0°
HAOACAOCAPHAP25.7°60.0°
HAOACAOCAPHAPA145.7°NaN°
CAQCAPHAPHAPA119.6°120.0°
CAPCAQCARHAQ120.0°120.0°
CAPCAQCARHAQA120.0°120.0°
CAPCAQHAQHAQA119.0°120.0°
CAPCAQCARCAS106.0°180.0°
CAPCAQCARHAR134.0°59.9°
CAPCAQCARHARA14.0°60.0°
HAPCAPCAQCAR171.9°60.0°
HAPCAPCAQHAQ68.1°180.0°
HAPCAPCAQHAQA51.9°60.0°
HAPACAPCAQCAR51.9°60.0°
HAPACAPCAQHAQ171.9°60.0°
HAPACAPCAQHAQA68.1°180.0°
CARCAQHAQHAQA119.1°120.0°
CAQCARCASHAR120.0°120.0°
CAQCARCASHARA120.0°120.0°
CAQCARHARHARA119.5°119.9°
CAQCARCASOAZ112.6°180.0°
CAQCARCASHAS127.4°60.0°
CAQCARCASHASA7.4°60.0°
HAQCAQCARCAS13.9°60.0°
HAQCAQCARHAR106.1°180.0°
HAQCAQCARHARA133.9°60.0°
HAQACAQCARCAS134.0°60.0°
HAQACAQCARHAR14.0°60.0°
HAQACAQCARHARA106.0°180.0°
CASCARHARHARA119.4°120.1°
CARCASOAZHAS120.0°120.1°
CARCASOAZHASA120.0°120.0°
CARCASHASHASA119.1°120.0°
CARCASOAZCBD125.3°180.0°
HARCARCASOAZ7.4°60.0°
HARCARCASHAS112.6°180.0°
HARCARCASHASA127.4°60.0°
HARACARCASOAZ127.4°60.1°
HARACARCASHAS7.4°60.0°
HARACARCASHASA112.6°180.0°
OAZCASHASHASA119.1°119.9°
HASCASOAZCBD5.3°59.9°
HASACASOAZCBD114.7°60.0°
OAYCATCAWHAT120.0°119.9°
OAYCATCAWHATA120.0°119.9°
OAYCATHATHATA127.6°120.1°
CATOAYCAUCAX89.3°62.5°
CATOAYCAUHAU150.7°177.5°
CATOAYCAUHAUA30.7°57.4°
OAYCATCAWNBH23.7°52.3°
OAYCATCAWHAW96.3°67.4°
OAYCATCAWHAWA143.7°172.1°
CAWCATHATHATA127.6°120.1°
CAWCATOAYCAU102.3°62.6°
CATCAWNBHHAW120.0°119.7°
CATCAWNBHHAWA120.0°119.8°
CATCAWHAWHAWA120.6°120.5°
CATCAWNBHCAX41.6°50.5°
CATCAWNBHSBI149.1°129.5°
HATCATOAYCAU137.7°57.3°
HATCATCAWNBH143.7°67.6°
HATCATCAWHAW23.7°172.7°
HATCATCAWHAWA96.3°52.2°
HATACATOAYCAU17.7°177.4°
HATACATCAWNBH96.3°172.2°
HATACATCAWHAW143.8°52.6°
HATACATCAWHAWA23.7°68.0°
CAXCAUOAYHAU120.0°120.0°
CAXCAUOAYHAUA120.0°120.0°
CAXCAUHAUHAUA126.9°120.2°
CAUCAXNBHCAW53.7°50.5°
CAUCAXNBHHAX120.0°119.7°
CAUCAXNBHHAXA120.0°119.7°
CAUCAXHAXHAXA120.1°120.5°
CAUCAXNBHSBI163.4°129.5°
OAYCAUHAUHAUA126.9°120.1°
OAYCAUCAXNBH5.8°52.3°
OAYCAUCAXHAX125.7°172.0°
OAYCAUCAXHAXA114.2°67.4°
HAUCAUCAXNBH125.8°172.2°
HAUCAUCAXHAX114.2°68.0°
HAUCAUCAXHAXA5.8°52.5°
HAUACAUCAXNBH114.3°67.7°
HAUACAUCAXHAX5.7°52.1°
HAUACAUCAXHAXA125.7°172.6°
OBACAVCBCHAV120.0°120.0°
OBACAVCBCHAVA120.0°119.9°
OBACAVHAVHAVA115.9°120.0°
CAVOBACBFCBG111.7°180.0°
CBCCAVHAVHAVA115.9°120.1°
CBCCAVOBACBF126.2°180.0°
HAVCAVOBACBF113.8°60.0°
HAVACAVOBACBF6.1°60.0°
NBHCAWHAWHAWA120.5°120.6°
CAWNBHCAXSBI109.7°180.0°
CAWNBHCAXHAX66.3°170.3°
CAWNBHCAXHAXA173.7°69.2°
CAWNBHSBICBE57.2°90.0°
HAWCAWNBHCAX161.6°69.2°
HAWCAWNBHSBI90.9°110.9°
HAWACAWNBHCAX78.4°170.3°
HAWACAWNBHSBI29.1°9.7°
NBHCAXHAXHAXA120.1°120.5°
CAXNBHSBICBE172.7°90.0°
HAXCAXNBHSBI43.4°9.7°
HAXACAXNBHSBI76.6°110.8°
OBACBFCBGCBB9.6°0.3°

224931

PDB entries from 2024-09-11

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