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C3T

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CADCBIsing1.53Å1.54Å
CACCBIsing1.53Å1.53Å
CBICBBsing1.51Å1.44Å
CBICAEsing1.53Å1.53Å
CBBCAMdoub1.38Å1.40ÅAromatic
CBBCALsing1.38Å1.40ÅAromatic
CAMCAKsing1.38Å1.39ÅAromatic
CALCAJdoub1.38Å1.39ÅAromatic
CAKCBAdoub1.38Å1.39ÅAromatic
CAJCBAsing1.38Å1.39ÅAromatic
CBACAPsing1.51Å1.38Å
CAPNAVsing1.46Å1.47Å
NAVCAYsing1.35Å1.34Å
OAGCAYdoub1.21Å1.24Å
CAYCBGsing1.50Å1.41Å
CBGCATsing1.57Å1.49Å
CBGNBHsing1.46Å1.48Å
CATCASsing1.57Å1.51Å
OAHCAZdoub1.22Å1.23Å
OAICAOsing1.43Å1.43Å
NBHCAZsing1.34Å1.32Å
NBHCBEsing1.48Å1.47Å
CAQCARsing1.53Å1.55Å
CAQCBDsing1.53Å1.56Å
CAZCBFsing1.50Å1.39Å
CARCBEsing1.52Å1.49Å
CASCBEsing1.57Å1.51Å
CAOCBDsing1.53Å1.53Å
CBDCBFsing1.52Å1.59Å
CBFNAWsing1.46Å1.47Å
NAWCsing1.35Å1.34Å
CAACBsing1.53Å1.53Å
CCAsing1.51Å1.52Å
COdoub1.21Å1.23Å
CANsing1.47Å1.47Å
CACBsing1.53Å1.51Å
NCABsing1.47Å1.48Å
CACH1sing1.09Å1.10Å
CACH2sing1.09Å1.10Å
CACH3sing1.09Å1.10Å
CADH4sing1.09Å1.10Å
CADH5sing1.09Å1.10Å
CADH6sing1.09Å1.10Å
CAEH7sing1.09Å1.10Å
CAEH8sing1.09Å1.10Å
CAEH9sing1.09Å1.10Å
CAMH10sing1.08Å1.08Å
CAKH11sing1.08Å1.08Å
CALH12sing1.08Å1.08Å
CAJH13sing1.08Å1.08Å
CAPH14sing1.09Å1.10Å
CAPH15sing1.09Å1.10Å
NAVH16sing0.97Å1.00Å
CBGH17sing1.09Å1.10Å
CATH18sing1.08Å1.10Å
CATH19sing1.08Å1.10Å
CASH20sing1.08Å1.10Å
CASH21sing1.08Å1.10Å
CBEH22sing1.07Å1.10Å
CARH23sing1.09Å1.10Å
CARH24sing1.09Å1.10Å
CAQH25sing1.09Å1.10Å
CAQH26sing1.10Å1.10Å
CBDH27sing1.09Å1.10Å
CAOH28sing1.09Å1.10Å
CAOH29sing1.09Å1.10Å
OAIH30sing0.97Å0.95Å
CBFH31sing1.10Å1.10Å
NAWH32sing0.97Å1.00Å
CAH33sing1.09Å1.10Å
CBH34sing1.09Å1.10Å
CBH35sing1.09Å1.10Å
CAAH36sing1.09Å1.10Å
CAAH37sing1.09Å1.10Å
CAAH38sing1.09Å1.10Å
NH39sing1.01Å1.00Å
CABH41sing1.09Å1.10Å
CABH42sing1.09Å1.10Å
CABH43sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CADCBICAC105.4°109.5°
CADCBICBB113.7°109.5°
CADCBICAE109.5°109.5°
CBICADH4109.5°109.5°
CBICADH5109.5°109.4°
CBICADH6109.5°109.5°
CACCBICBB110.4°109.4°
CACCBICAE108.3°109.5°
CBICACH1109.5°109.5°
CBICACH2109.5°109.4°
CBICACH3109.5°109.5°
CBBCBICAE109.4°109.4°
CBICBBCAM123.7°120.0°
CBICBBCAL120.0°120.0°
CBICAEH7109.5°109.5°
CBICAEH8109.5°109.4°
CBICAEH9109.5°109.4°
CAMCBBCAL116.2°120.0°
CBBCAMCAK121.4°120.0°
CBBCAMH10119.3°120.0°
CBBCALCAJ122.4°120.0°
CBBCALH12118.8°120.1°
CAMCAKCBA121.0°120.1°
CAKCAMH10119.3°120.1°
CAMCAKH11119.5°119.9°
CALCAJCBA120.6°120.0°
CAJCALH12118.8°120.0°
CALCAJH13119.7°120.1°
CAKCBACAJ118.3°120.0°
CAKCBACAP122.1°120.0°
CBACAKH11119.5°120.0°
CAJCBACAP119.5°120.0°
CBACAJH13119.7°119.9°
CBACAPNAV105.6°109.5°
CBACAPH14110.5°109.4°
CBACAPH15110.4°109.4°
CAPNAVCAY122.7°120.0°
NAVCAPH14110.4°109.5°
NAVCAPH15110.5°109.5°
CAPNAVH16118.6°120.0°
NAVCAYOAG123.5°120.0°
NAVCAYCBG115.2°120.0°
CAYNAVH16118.6°120.0°
OAGCAYCBG121.2°120.0°
CAYCBGCAT107.6°108.9°
CAYCBGNBH112.0°112.2°
CAYCBGH17110.9°110.8°
CATCBGNBH106.6°104.6°
CBGCATCAS102.9°97.3°
CATCBGH17109.7°108.7°
CBGCATH18111.1°110.6°
CBGCATH19111.1°110.6°
CBGNBHCAZ130.9°125.1°
CBGNBHCBE109.4°109.4°
NBHCBGH17109.9°111.4°
CATCASCBE104.6°97.0°
CASCATH18111.1°111.0°
CASCATH19111.1°111.0°
CATCASH20110.7°112.3°
CATCASH21110.7°110.9°
OAHCAZNBH117.3°118.3°
OAHCAZCBF120.0°117.5°
OAICAOCBD107.4°109.5°
OAICAOH28110.0°109.5°
OAICAOH29110.0°109.5°
CAOOAIH30109.5°114.0°
CAZNBHCBE119.6°125.5°
NBHCAZCBF122.5°124.3°
NBHCBECAR112.5°111.6°
NBHCBECAS103.1°98.9°
NBHCBEH22110.1°112.8°
CARCAQCBD113.9°110.7°
CAQCARCBE109.6°109.0°
CAQCARH23109.4°110.7°
CAQCARH24109.4°109.1°
CARCAQH25108.3°109.9°
CARCAQH26108.4°108.8°
CAQCBDCAO110.2°109.4°
CAQCBDCBF112.9°110.2°
CBDCAQH25108.3°110.2°
CBDCAQH26108.3°109.0°
CAQCBDH27106.4°109.6°
CAZCBFCBD114.7°112.6°
CAZCBFNAW110.7°110.3°
CAZCBFH31106.5°107.6°
CARCBECAS111.7°107.8°
CARCBEH22109.8°113.6°
CBECARH23109.5°110.1°
CBECARH24109.4°109.1°
CBECASH20110.7°111.1°
CBECASH21110.7°110.3°
CASCBEH22109.5°111.1°
CAOCBDCBF114.1°109.5°
CAOCBDH27106.6°108.6°
CBDCAOH28110.0°109.5°
CBDCAOH29110.0°109.5°
CBDCBFNAW113.9°110.9°
CBFCBDH27106.1°109.5°
CBDCBFH31104.4°107.7°
CBFNAWC118.4°120.0°
NAWCBFH31105.7°107.4°
CBFNAWH32120.8°120.0°
NAWCCA116.2°120.0°
NAWCO123.1°119.9°
CNAWH32120.8°119.9°
CAACBCA105.6°109.5°
CAACBH34110.4°109.5°
CAACBH35110.4°109.5°
CBCAAH36109.5°109.5°
CBCAAH37109.5°109.5°
CBCAAH38109.5°109.5°
CACO120.7°120.0°
CCAN108.4°109.5°
CCACB105.3°109.5°
CCAH33108.8°109.5°
NCACB115.8°109.4°
CANCAB112.7°111.1°
NCAH33109.4°109.4°
CANH39108.7°111.0°
CBCAH33108.8°109.5°
CACBH34110.5°109.4°
CACBH35110.4°109.5°
CABNH39108.6°111.0°
NCABH41109.5°109.5°
NCABH42109.4°109.5°
NCABH43109.5°109.5°
H1CACH2109.5°109.4°
H1CACH3109.4°109.5°
H2CACH3109.4°109.5°
H4CADH5109.5°109.4°
H4CADH6109.5°109.5°
H5CADH6109.4°109.5°
H7CAEH8109.4°109.5°
H7CAEH9109.5°109.5°
H8CAEH9109.5°109.5°
H14CAPH15109.5°109.5°
H18CATH19109.5°115.0°
H20CASH21109.5°114.1°
H23CARH24109.4°108.7°
H25CAQH26109.5°108.3°
H28CAOH29109.4°109.4°
H34CBH35109.5°109.5°
H36CAAH37109.5°109.5°
H36CAAH38109.4°109.5°
H37CAAH38109.5°109.4°
H41CABH42109.4°109.5°
H41CABH43109.5°109.4°
H42CABH43109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CADCBICACCBB123.1°120.0°
CADCBICACCAE117.1°120.0°
CADCBICBBCAE122.8°120.0°
CADCBICBBCAM17.5°59.9°
CADCBICBBCAL163.5°119.7°
CADCBICACH1180.0°180.0°
CADCBICACH260.0°60.0°
CADCBICACH360.0°60.0°
CBICADH4H5120.0°119.9°
CBICADH4H6120.0°120.0°
CBICADH5H6120.0°120.0°
CADCBICAEH7180.0°180.0°
CADCBICAEH860.0°60.0°
CADCBICAEH960.0°60.0°
CACCBICBBCAE119.1°120.0°
CACCBICBBCAM135.7°60.0°
CACCBICBBCAL45.3°120.3°
CBICACH1H2120.0°119.9°
CBICACH1H3120.0°120.1°
CBICACH2H3120.0°120.0°
CACCBICADH4180.0°60.1°
CACCBICADH560.0°180.0°
CACCBICADH660.0°59.9°
CACCBICAEH765.6°60.0°
CACCBICAEH854.4°180.0°
CACCBICAEH9174.4°60.0°
CBICBBCAMCAL179.0°179.6°
CBICBBCAMCAK179.7°180.0°
CBICBBCALCAJ179.9°180.0°
CBBCBICACH156.9°60.0°
CBBCBICACH263.2°180.0°
CBBCBICACH3176.9°60.0°
CBBCBICADH459.0°180.0°
CBBCBICADH5179.0°60.0°
CBBCBICADH661.0°60.0°
CBBCBICAEH754.7°60.0°
CBBCBICAEH8174.7°60.1°
CBBCBICAEH965.2°180.0°
CBICBBCAMH100.3°0.1°
CBICBBCALH120.1°0.1°
CAECBICBBCAM105.3°180.0°
CAECBICBBCAL73.8°0.3°
CAECBICACH162.9°59.9°
CAECBICACH2177.1°60.0°
CAECBICACH357.1°180.0°
CAECBICADH463.7°60.0°
CAECBICADH556.3°60.0°
CAECBICADH6176.2°180.0°
CBICAEH7H8120.0°120.0°
CBICAEH7H9120.0°120.0°
CBICAEH8H9120.0°119.9°
CBBCAMCAKH10180.0°180.0°
CAMCBBCALCAJ0.8°0.4°
CBBCAMCAKCBA1.1°0.0°
CBBCAMCAKH11178.9°179.9°
CAMCBBCALH12179.2°179.7°
CALCBBCAMCAK1.2°0.3°
CBBCALCAJH12180.0°179.9°
CBBCALCAJCBA0.3°0.1°
CALCBBCAMH10178.8°179.7°
CBBCALCAJH13179.7°180.0°
CAMCAKCBAH11180.0°179.9°
CAMCAKCBACAJ0.5°0.2°
CAMCAKCBACAP179.6°180.0°
CALCAJCBACAK0.0°0.2°
CALCAJCBAH13180.0°179.9°
CALCAJCBACAP179.2°180.0°
CAKCBACAJCAP179.1°179.8°
CAKCBACAPNAV113.7°90.0°
CBACAKCAMH10178.9°180.0°
CAKCBACAJH13180.0°179.7°
CAKCBACAPH145.7°150.0°
CAKCBACAPH15126.9°30.0°
CAJCBACAPNAV67.2°89.8°
CAJCBACAKH11179.5°179.9°
CBACAJCALH12179.7°179.9°
CAJCBACAPH14173.4°30.2°
CAJCBACAPH1552.2°150.1°
CBACAPNAVH14119.4°120.0°
CBACAPNAVH15119.4°120.0°
CBACAPNAVCAY146.8°179.9°
CAPCBACAKH110.4°0.1°
CAPCBACAJH130.8°0.1°
CBACAPH14H15121.8°119.9°
CBACAPNAVH1633.2°0.0°
CAPNAVCAYH16180.0°179.9°
CAPNAVCAYOAG1.9°0.1°
CAPNAVCAYCBG176.6°180.0°
NAVCAPH14H15121.8°120.1°
NAVCAYOAGCBG178.4°179.9°
NAVCAYCBGCAT117.5°61.5°
NAVCAYCBGNBH125.7°176.9°
CAYNAVCAPH1493.8°60.1°
CAYNAVCAPH1527.4°59.9°
NAVCAYCBGH172.6°57.9°
OAGCAYCBGCAT61.1°118.6°
OAGCAYCBGNBH55.7°3.2°
OAGCAYNAVH16178.1°180.0°
OAGCAYCBGH17178.9°122.0°
CAYCBGCATNBH120.3°120.2°
CAYCBGCATH17120.7°120.8°
CAYCBGNBHH17123.7°124.8°
CAYCBGCATCAS144.2°85.5°
CAYCBGNBHCAZ59.9°65.1°
CAYCBGNBHCBE120.5°116.1°
CBGCAYNAVH163.4°0.1°
CAYCBGCATH1825.3°30.3°
CAYCBGCATH1996.9°158.8°
CATCBGNBHH17118.9°117.2°
CBGCATCASH18118.9°115.4°
CBGCATCASH19118.9°115.4°
CATCBGNBHCAZ177.3°176.9°
CATCBGNBHCBE3.1°1.8°
CBGCATCASCBE35.9°52.7°
CBGCATH18H19123.0°126.2°
CBGCATCASH20155.1°63.5°
CBGCATCASH2183.3°167.6°
NBHCBGCATCAS23.9°34.7°
CBGNBHCAZOAH2.1°11.6°
CBGNBHCAZCBE179.6°178.5°
CBGNBHCAZCBF177.9°167.6°
CBGNBHCBECAR101.3°145.2°
CBGNBHCBECAS19.2°32.0°
NBHCBGCATH1895.0°150.5°
NBHCBGCATH19142.9°81.0°
CBGNBHCBEH22135.9°85.4°
CATCASCBENBH33.9°52.5°
CATCASCBECAR87.1°168.7°
CATCASCBEH20119.2°117.1°
CATCASCBEH21119.2°115.3°
CASCATCBGH1795.0°153.8°
CASCATH18H19123.0°127.0°
CATCASH20H21122.3°127.2°
CATCASCBEH22151.1°66.3°
OAHCAZNBHCBF175.8°179.2°
OAHCAZNBHCBE177.5°169.9°
OAHCAZCBFCBD124.8°155.8°
OAHCAZCBFNAW5.8°79.7°
OAHCAZCBFH31120.2°37.2°
OAICAOCBDCAQ41.1°65.0°
OAICAOCBDH28119.7°120.0°
OAICAOCBDH29119.7°120.0°
OAICAOCBDCBF87.1°174.2°
OAICAOCBDH27156.2°54.6°
OAICAOH28H29121.0°120.0°
CAZNBHCBECAR79.1°36.1°
CAZNBHCBECAS160.5°149.3°
NBHCAZCBFCBD59.5°23.4°
NBHCAZCBFNAW169.9°101.1°
CAZNBHCBGH1763.8°59.7°
CAZNBHCBEH2243.8°93.3°
NBHCAZCBFH3155.5°142.0°
NBHCBECARCAQ41.0°89.7°
CBENBHCAZCBF1.7°10.9°
NBHCBECARCAS115.4°107.6°
NBHCBECARH22123.0°128.9°
NBHCBECASH22117.2°118.7°
CBENBHCBGH17115.8°119.0°
NBHCBECASH20153.2°64.6°
NBHCBECASH2185.3°167.8°
NBHCBECARH23161.1°32.0°
NBHCBECARH2479.0°151.3°
CARCAQCBDH25120.6°121.7°
CARCAQCBDH26120.7°119.6°
CAQCARCBEH23120.0°121.7°
CAQCARCBEH24120.0°119.0°
CAQCARCBECAS156.5°162.7°
CARCAQCBDCAO161.6°172.9°
CARCAQCBDCBF69.5°52.4°
CAQCARCBEH2281.9°39.2°
CAQCARH23H24119.9°119.8°
CARCAQH25H26118.0°118.7°
CARCAQCBDH2746.4°68.1°
CAQCBDCBFCAZ9.4°85.9°
CBDCAQCARCBE49.3°40.7°
CAQCBDCAOCBF128.2°120.9°
CAQCBDCAOH27115.0°119.6°
CAQCBDCBFH27116.1°120.6°
CAQCBDCBFNAW138.4°38.3°
CBDCAQCARH2370.7°80.6°
CBDCAQCARH24169.4°159.8°
CBDCAQH25H26117.9°119.1°
CAQCBDCAOH28160.8°175.0°
CAQCBDCAOH2978.6°55.1°
CAQCBDCBFH31106.8°155.6°
CAZCBFCBDCAO117.5°153.7°
CAZCBFCBDNAW129.0°124.2°
CAZCBFCBDH31116.2°118.5°
CAZCBFNAWH31114.9°117.0°
CAZCBFNAWC148.5°85.0°
CAZCBFCBDH27125.5°34.7°
CAZCBFNAWH3231.5°95.0°
CARCBECASH22121.8°125.0°
CARCBECASH2032.2°51.6°
CARCBECASH21153.7°76.0°
CBECARH23H24119.9°119.5°
CBECARCAQH2571.3°162.7°
CBECARCAQH26170.0°79.0°
CBECASCATH1883.1°168.2°
CBECASCATH19154.8°62.7°
CBECASH20H21122.2°125.4°
CASCBECARH2383.5°75.5°
CASCBECARH2436.4°43.7°
CAOCBDCBFH27117.1°119.0°
CAOCBDCBFNAW11.6°82.1°
CAOCBDCAQH2577.7°51.1°
CAOCBDCAQH2640.9°67.5°
CBDCAOH28H29120.9°120.0°
CBDCAOOAIH30180.0°180.0°
CAOCBDCBFH31126.4°35.2°
CBDCBFNAWH31114.1°117.4°
CBDCBFNAWC80.5°149.4°
CBFCBDCAQH2551.2°69.3°
CBFCBDCAQH26169.8°172.0°
CBFCBDCAOH2832.6°54.2°
CBFCBDCAOH29153.2°65.8°
CBDCBFNAWH3299.5°30.5°
CBFNAWCH32180.0°179.9°
CBFNAWCCA176.9°180.0°
CBFNAWCO3.2°0.0°
NAWCBFCBDH27105.5°158.9°
NAWCCAO179.9°179.9°
NAWCCAN124.8°180.0°
NAWCCACB110.7°60.0°
CNAWCBFH3133.6°32.0°
NAWCCAH335.9°60.0°
CAACBCAC90.6°60.9°
CAACBCAN149.7°59.2°
CAACBCAH34119.4°120.0°
CAACBCAH35119.4°120.0°
CAACBCAH3325.9°179.1°
CAACBH34H35121.7°120.0°
CBCAAH36H37120.0°120.0°
CBCAAH36H38120.0°120.0°
CBCAAH37H38120.0°120.0°
CCANCB118.1°120.1°
CCANH33118.5°120.0°
CCACBH33116.5°120.0°
CCANCAB74.3°157.0°
CACNAWH323.0°0.1°
CCACBH3428.8°59.1°
CCACBH35150.1°179.1°
CCANH39165.3°33.0°
OCCAN55.1°0.1°
OCCACB69.5°120.0°
OCNAWH32176.8°180.0°
OCCAH33174.0°120.0°
NCACBH33123.7°119.9°
CANCABH39120.5°124.0°
NCACBH3490.9°179.1°
NCACBH3530.3°60.9°
CANCABH41180.0°174.9°
CANCABH4260.0°65.1°
CANCABH4360.0°54.9°
CBCANCAB43.8°83.0°
CACBH34H35121.8°120.1°
CACBCAAH36180.0°174.8°
CACBCAAH3760.0°54.8°
CACBCAAH3860.0°65.2°
CBCANH3976.7°153.0°
CABNCAH33167.2°37.0°
NCABH41H42120.0°120.1°
NCABH41H43120.0°120.0°
NCABH42H43120.0°120.0°
H1CACH2H3119.9°120.0°
H4CADH5H6120.0°120.0°
H7CAEH8H9120.0°120.0°
H10CAMCAKH111.1°0.1°
H12CALCAJH130.3°0.1°
H14CAPNAVH1686.2°120.0°
H15CAPNAVH16152.6°120.0°
H17CBGCATH18146.0°90.5°
H17CBGCATH1923.9°38.0°
H18CATCASH2036.2°51.9°
H18CATCASH21157.7°76.9°
H19CATCASH2086.0°178.9°
H19CATCASH2135.6°52.2°
H20CASCBEH2289.6°176.6°
H21CASCBEH2231.9°49.1°
H22CBECARH2338.1°161.0°
H22CBECARH24158.0°79.8°
H23CARCAQH25168.6°41.3°
H23CARCAQH2649.9°159.7°
H24CARCAQH2548.7°78.3°
H24CARCAQH2670.0°40.1°
H25CAQCBDH27167.0°170.1°
H26CAQCBDH2774.3°51.4°
H27CBDCAOH2884.1°65.4°
H27CBDCAOH2936.5°174.6°
H27CBDCBFH319.3°83.9°
H28CAOOAIH3060.3°59.9°
H29CAOOAIH3060.3°60.0°
H31CBFNAWH32146.4°147.9°
H33CACBH34145.3°60.9°
H33CACBH3593.4°59.1°
H33CANH3946.8°87.0°
H34CBCAAH3660.6°65.2°
H34CBCAAH3759.4°174.7°
H34CBCAAH38179.4°54.8°
H35CBCAAH3660.6°54.7°
H35CBCAAH37179.4°65.3°
H35CBCAAH3859.4°174.8°
H36CAAH37H38120.0°120.0°
H39NCABH4159.5°50.9°
H39NCABH42179.5°170.9°
H39NCABH4360.5°69.1°
H41CABH42H43120.0°119.9°

222624

PDB entries from 2024-07-17

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